data_2jto_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 2jto _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 121.004 0.43 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -49.6 -58.28 5.55 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.985 0.914 . . . . 0.0 111.477 177.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.63 -31.22 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.322 0.649 . . . . 0.0 112.438 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.67 -29.45 69.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.636 1.174 . . . . 0.0 111.318 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mmmp? -96.7 -9.53 28.87 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 117.286 -1.34 . . . . 0.0 114.169 174.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 84.25 34.42 17.38 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 125.107 1.504 . . . . 0.0 112.541 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.524 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 59.1 m-85 -87.58 170.53 11.23 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.985 1.314 . . . . 0.0 112.574 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.72 123.9 5.85 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.794 -0.923 . . . . 0.0 110.794 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -74.26 131.59 41.33 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 118.799 -0.62 . . . . 0.0 111.252 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 mt -144.72 160.67 46.54 Favored Pre-proline 0 CA--C 1.53 0.199 0 O-C-N 124.075 0.859 . . . . 0.0 111.071 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.446 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 55.4 Cg_endo -67.07 137.73 45.25 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.484 2.789 . . . . 0.0 110.913 174.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -52.08 -23.17 4.9 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 175.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 t -70.38 -46.44 64.06 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 124.257 1.023 . . . . 0.0 113.208 171.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -72.85 -41.17 65.06 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.957 0.903 . . . . 0.0 110.197 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.1 t -85.38 124.44 71.69 Favored Pre-proline 0 CA--C 1.541 0.622 0 O-C-N 120.591 -1.318 . . . . 0.0 111.715 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -62.71 145.73 95.05 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.696 2.264 . . . . 0.0 110.494 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -52.87 -21.33 4.14 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.72 -34.08 40.35 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.671 1.588 . . . . 0.0 112.62 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.61 -25.14 28.79 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 117.881 -1.056 . . . . 0.0 112.481 177.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -49.18 111.35 0.47 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.176 0.898 . . . . 0.0 110.933 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.7 mt -93.8 174.71 7.04 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.725 0.774 . . . . 0.0 109.879 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 m -115.14 25.24 11.03 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.009 1.324 . . . . 0.0 111.86 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.524 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 52.0 m-85 -67.93 -11.72 59.3 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.865 175.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 45.0 80.42 0.05 OUTLIER Glycine 0 N--CA 1.473 1.166 0 CA-C-N 120.882 1.673 . . . . 0.0 114.404 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 177.64 27.73 0.04 OUTLIER Glycine 0 C--O 1.226 -0.355 0 O-C-N 120.643 -1.504 . . . . 0.0 113.401 -174.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.7 m -125.89 159.26 33.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.762 0.825 . . . . 0.0 110.872 176.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.4 p -43.18 -43.58 4.73 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.463 1.105 . . . . 0.0 112.899 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.446 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 1.3 t -137.81 -61.82 0.61 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.963 1.705 . . . . 0.0 111.311 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.8 p -138.57 151.62 24.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 122.132 0.968 . . . . 0.0 110.387 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -90.76 134.1 34.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.26 173.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.81 141.26 41.09 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.113 0.965 . . . . 0.0 111.826 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -81.32 103.19 10.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.46 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.4 mt -63.61 -32.71 74.26 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 121.063 -1.023 . . . . 0.0 110.825 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.5 t . . . . . 0 N--CA 1.466 0.36 0 O-C-N 119.352 -2.093 . . . . 0.0 112.709 176.694 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.4 mttm . . . . . 0 N--CA 1.468 0.449 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.71 -34.98 79.44 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-O 119.695 -0.503 . . . . 0.0 113.354 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -80.07 14.82 1.7 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.627 1.171 . . . . 0.0 113.781 173.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.05 45.15 52.36 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 123.791 0.71 . . . . 0.0 113.265 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -124.43 159.66 19.05 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.594 1.568 . . . . 0.0 112.764 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -147.51 153.55 39.65 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.676 1.227 . . . . 0.0 111.477 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.2 m -64.34 124.31 21.41 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.927 -1.108 . . . . 0.0 112.507 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -122.64 147.97 51.96 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-O 122.019 0.914 . . . . 0.0 111.258 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.23 153.24 71.68 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.212 1.941 . . . . 0.0 110.416 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.5 mt -60.08 -22.06 62.25 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 175.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.66 -18.59 60.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.015 1.326 . . . . 0.0 112.591 175.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.9 tpp85 -87.27 127.66 35.17 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.454 176.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.03 119.38 19.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.742 175.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.2 t -165.69 176.05 8.34 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.214 1.006 . . . . 0.0 110.401 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -96.91 110.45 22.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.779 1.231 . . . . 0.0 110.466 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -111.01 138.12 47.81 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.455 1.102 . . . . 0.0 110.727 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 13.2 mt -89.16 153.2 21.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.455 -0.778 . . . . 0.0 110.433 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -63.92 -36.28 83.41 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.416 -0.802 . . . . 0.0 112.102 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.1 50.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.486 0.714 . . . . 0.0 112.285 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -81.24 -33.61 32.7 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.2 m -56.27 -31.46 63.62 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.051 -1.031 . . . . 0.0 112.16 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -40.08 70.11 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.338 1.055 . . . . 0.0 112.746 175.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -48.0 -58.64 4.17 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.423 1.489 . . . . 0.0 111.938 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.7 m -64.36 -49.64 70.86 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.593 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.13 -169.68 12.97 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-O 123.097 1.387 . . . . 0.0 112.759 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -64.94 136.74 57.18 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.713 -1.463 . . . . 0.0 111.73 177.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.05 5.33 89.33 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 119.328 -0.707 . . . . 0.0 113.56 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -136.89 161.14 36.82 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.734 1.214 . . . . 0.0 110.951 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.9 mttt -138.47 121.4 16.61 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.759 1.224 . . . . 0.0 110.659 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.6 t -73.8 106.92 5.74 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.7 -0.625 . . . . 0.0 111.048 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.457 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.9 OUTLIER -91.21 151.84 20.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.402 0.62 . . . . 0.0 110.662 177.153 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.75 145.48 34.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 124.209 1.003 . . . . 0.0 110.601 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.457 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 47.2 m95 . . . . . 0 C--O 1.222 -0.37 0 CA-C-O 121.569 0.699 . . . . 0.0 111.51 175.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.472 0.672 0 CA-C-O 120.754 0.311 . . . . 0.0 111.732 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.481 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 63.3 m -51.5 -56.61 12.44 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.743 1.217 . . . . 0.0 110.201 176.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.18 -32.06 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.532 1.133 . . . . 0.0 113.827 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.5 t -61.23 -33.73 73.97 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.063 1.345 . . . . 0.0 111.37 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -96.03 -5.82 40.17 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 82.61 30.06 34.0 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-O 117.695 -1.614 . . . . 0.0 113.347 -177.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -75.11 168.66 19.56 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.458 1.629 . . . . 0.0 112.936 174.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.81 114.63 3.17 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.293 1.425 . . . . 0.0 111.435 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.5 m -66.04 131.45 46.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.748 172.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.8 mt -145.11 155.63 54.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 124.04 0.838 . . . . 0.0 111.496 176.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.402 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 58.2 Cg_endo -63.43 138.27 64.66 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.509 2.139 . . . . 0.0 110.587 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -25.55 1.99 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 p -71.09 -41.17 70.98 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.998 0.919 . . . . 0.0 112.921 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -78.91 -46.22 18.92 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.822 1.649 . . . . 0.0 111.567 176.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.3 t -88.08 121.67 70.41 Favored Pre-proline 0 C--O 1.244 0.799 0 C-N-CA 124.142 0.977 . . . . 0.0 111.485 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -61.47 144.5 98.06 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.74 2.293 . . . . 0.0 110.5 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.2 pp0? -47.38 -30.12 3.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.214 1.006 . . . . 0.0 113.688 175.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -69.7 -32.97 71.87 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.962 1.305 . . . . 0.0 113.739 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.67 -20.42 21.62 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.749 1.22 . . . . 0.0 112.506 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 73.5 mtt180 -51.1 100.34 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 112.272 173.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 41.9 mt -84.28 166.41 17.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.967 0.889 . . . . 0.0 111.214 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -113.79 29.3 8.1 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.184 1.794 . . . . 0.0 112.277 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.481 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 15.2 m-85 -68.17 -17.95 64.48 Favored 'General case' 0 C--O 1.211 -0.944 0 O-C-N 121.255 -0.903 . . . . 0.0 112.57 175.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.1 74.38 0.41 Allowed Glycine 0 N--CA 1.473 1.11 0 CA-C-O 123.767 1.759 . . . . 0.0 113.29 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.73 36.54 0.07 OUTLIER Glycine 0 C--O 1.224 -0.47 0 O-C-N 120.691 -1.476 . . . . 0.0 112.299 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 53.3 m -134.75 160.95 36.57 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 117.012 0.406 . . . . 0.0 111.545 170.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.8 m -54.68 -37.61 65.98 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.121 0.969 . . . . 0.0 112.966 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.402 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -135.44 -56.34 0.79 Allowed 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.279 1.432 . . . . 0.0 110.382 -179.474 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.4 p -152.76 145.49 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.992 0.917 . . . . 0.0 111.898 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 61.2 m -86.2 134.33 33.79 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.091 172.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.62 146.59 29.48 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.108 0.963 . . . . 0.0 110.962 172.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -86.21 107.35 17.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.723 0.809 . . . . 0.0 112.05 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.34 -29.56 70.54 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.469 -0.77 . . . . 0.0 111.704 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.4 m . . . . . 0 N--CA 1.47 0.534 0 O-C-N 119.818 -1.801 . . . . 0.0 113.087 176.246 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.532 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.18 65.92 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-N 118.261 0.482 . . . . 0.0 113.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -88.75 12.27 15.41 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.015 1.726 . . . . 0.0 113.52 173.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.47 40.47 9.92 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.691 1.139 . . . . 0.0 112.411 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.14 165.02 31.33 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 121.566 0.537 . . . . 0.0 113.578 174.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -146.93 154.61 41.48 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.912 1.285 . . . . 0.0 112.081 -176.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.0 t -73.28 127.14 31.79 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.716 -1.24 . . . . 0.0 110.604 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -126.33 149.93 68.66 Favored Pre-proline 0 CA--C 1.543 0.695 0 C-N-CA 123.607 0.763 . . . . 0.0 111.074 -178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.28 158.91 55.51 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.524 2.15 . . . . 0.0 111.744 176.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.0 mt -61.71 -19.79 62.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.525 0.73 . . . . 0.0 112.935 176.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -80.99 -15.41 56.29 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.004 2.122 . . . . 0.0 112.618 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -87.12 137.33 32.44 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 120.962 -1.087 . . . . 0.0 109.718 174.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.6 120.41 28.89 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.793 1.237 . . . . 0.0 111.075 172.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.13 -177.91 5.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.003 0.921 . . . . 0.0 110.361 174.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.62 112.51 22.39 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.357 -0.839 . . . . 0.0 110.404 170.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.28 133.03 50.21 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.308 1.443 . . . . 0.0 113.02 177.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mt -87.52 154.77 20.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 120.435 -1.416 . . . . 0.0 110.265 177.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -68.3 -36.79 79.87 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.92 -37.56 67.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.062 0.545 . . . . 0.0 110.993 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -75.99 -30.5 58.58 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.1 t -49.08 -44.77 42.29 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.273 0.629 . . . . 0.0 112.179 171.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.62 -38.75 72.51 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.511 -0.757 . . . . 0.0 112.978 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.6 t -51.11 -44.75 61.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.527 1.531 . . . . 0.0 112.725 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.8 m -68.4 -60.29 2.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.409 0.684 . . . . 0.0 112.152 172.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 136.55 -156.73 23.26 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 122.387 0.993 . . . . 0.0 113.816 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -80.88 133.14 35.52 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.762 -1.434 . . . . 0.0 111.574 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.24 10.0 84.29 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 123.916 0.77 . . . . 0.0 114.381 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -137.56 155.14 49.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.013 1.325 . . . . 0.0 109.948 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -136.26 131.04 33.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.503 1.921 . . . . 0.0 109.437 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.4 t -73.56 111.04 8.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.404 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 40.5 m -106.21 161.29 14.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.557 0.694 . . . . 0.0 111.724 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p -129.59 144.16 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 123.556 0.743 . . . . 0.0 111.121 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.4 m95 . . . . . 0 C--O 1.235 0.315 0 CA-C-O 122.484 1.135 . . . . 0.0 111.008 174.901 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 . . . . . 0 N--CA 1.471 0.595 0 CA-C-O 120.809 0.338 . . . . 0.0 111.34 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.555 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 87.4 m -50.83 -51.26 52.85 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.093 -1.004 . . . . 0.0 111.109 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -59.33 -32.35 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.202 1.001 . . . . 0.0 113.302 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.4 t -67.04 -29.07 68.77 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.66 1.584 . . . . 0.0 111.309 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.405 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 35.1 mmtt -94.31 -5.59 46.32 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 172.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.08 37.22 25.74 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-O 118.293 -1.282 . . . . 0.0 112.947 -177.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.438 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 43.1 m-85 -98.87 161.53 13.58 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.636 1.975 . . . . 0.0 112.216 174.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.72 130.49 9.12 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.303 0.954 . . . . 0.0 111.528 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.3 134.2 48.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 118.105 -0.95 . . . . 0.0 111.939 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.2 mt -145.39 156.15 53.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 O-C-N 123.741 0.651 . . . . 0.0 110.986 175.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -66.81 140.08 54.34 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.377 2.052 . . . . 0.0 110.4 174.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -49.4 -23.58 1.57 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 174.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 p -70.78 -44.48 66.57 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.651 1.18 . . . . 0.0 112.698 173.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -79.67 -42.22 25.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.923 1.689 . . . . 0.0 111.766 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.5 t -89.73 122.22 68.28 Favored Pre-proline 0 C--O 1.245 0.865 0 C-N-CA 124.525 1.13 . . . . 0.0 111.847 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.18 146.73 94.27 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.866 2.377 . . . . 0.0 110.85 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -51.39 -29.08 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -70.2 -24.65 63.16 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.67 -17.53 17.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.446 1.899 . . . . 0.0 113.984 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -57.11 101.33 0.06 Allowed 'General case' 0 N--CA 1.463 0.186 0 O-C-N 121.307 -0.871 . . . . 0.0 111.113 173.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.8 mt -85.21 168.12 15.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 122.406 1.098 . . . . 0.0 110.815 177.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -120.59 30.6 6.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.428 1.891 . . . . 0.0 112.403 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.555 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 38.6 m-85 -67.46 -16.48 64.24 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 121.535 -0.728 . . . . 0.0 112.667 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.07 67.07 2.14 Favored Glycine 0 N--CA 1.469 0.897 0 CA-C-N 119.825 1.193 . . . . 0.0 112.831 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -164.34 25.24 0.18 Allowed Glycine 0 N--CA 1.462 0.426 0 O-C-N 120.983 -1.304 . . . . 0.0 114.276 -177.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 55.4 m -132.39 151.03 52.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.866 0.866 . . . . 0.0 111.541 175.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.9 m -53.36 -41.82 66.21 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.191 0.997 . . . . 0.0 112.941 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.0 -72.64 0.68 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.993 1.717 . . . . 0.0 109.581 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.3 p -143.97 140.62 25.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.413 1.085 . . . . 0.0 111.227 -177.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 97.4 m -79.8 137.89 37.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.043 -1.036 . . . . 0.0 109.477 172.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.67 133.22 53.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.349 1.06 . . . . 0.0 111.766 172.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.438 ' HA ' ' CD1' ' A' ' 8' ' ' PHE . 1.1 p30 -80.27 97.22 6.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 123.436 1.589 . . . . 0.0 113.937 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 mt -59.24 -41.26 88.29 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 119.785 -1.822 . . . . 0.0 110.955 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.511 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.229 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.74 -27.98 69.24 Favored Glycine 0 CA--C 1.534 1.245 0 CA-C-O 119.358 -0.69 . . . . 0.0 112.978 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -86.27 13.25 8.32 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.391 2.276 . . . . 0.0 113.318 173.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.34 37.16 54.53 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-N 118.252 0.478 . . . . 0.0 113.055 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.14 162.18 13.19 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 125.639 1.59 . . . . 0.0 113.466 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -142.95 150.12 39.29 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 124.756 1.222 . . . . 0.0 109.894 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 96.5 m -61.89 114.46 3.37 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.388 -0.82 . . . . 0.0 111.8 174.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -116.14 148.23 41.06 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.521 1.128 . . . . 0.0 111.015 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.48 152.26 78.85 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.774 2.316 . . . . 0.0 111.186 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.5 mt -60.75 -20.92 62.38 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.98 -20.26 59.74 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.528 1.531 . . . . 0.0 112.468 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -86.03 128.17 34.81 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 120.781 -1.199 . . . . 0.0 109.959 176.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.82 118.87 23.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.493 0.717 . . . . 0.0 110.926 174.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.19 173.86 11.89 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.516 1.126 . . . . 0.0 110.354 176.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.3 ttmt -82.33 114.32 20.72 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.84 129.77 51.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.608 1.563 . . . . 0.0 112.316 177.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 21.9 tp -85.47 136.08 33.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 120.642 -1.286 . . . . 0.0 110.067 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -54.12 -38.1 65.06 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.695 -1.253 . . . . 0.0 113.982 172.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.48 -33.53 74.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.025 0.93 . . . . 0.0 110.546 177.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -79.32 -33.02 43.51 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.232 1.013 . . . . 0.0 112.206 178.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 p -55.07 -28.86 55.54 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.224 1.01 . . . . 0.0 113.477 176.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.84 -35.26 77.73 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.404 1.082 . . . . 0.0 112.851 174.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.8 t -56.48 -45.54 80.88 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.877 1.271 . . . . 0.0 112.179 178.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 66.6 m -74.91 -43.11 56.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.299 0.64 . . . . 0.0 112.512 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 114.93 -146.75 18.86 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 122.414 1.008 . . . . 0.0 112.586 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -87.62 147.04 25.46 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.116 -1.226 . . . . 0.0 111.947 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.87 6.92 74.25 Favored Glycine 0 CA--C 1.538 1.51 0 N-CA-C 114.272 0.469 . . . . 0.0 114.272 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -138.51 153.45 48.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.486 1.514 . . . . 0.0 109.754 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.8 mmtp -134.14 125.49 28.02 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 126.252 1.821 . . . . 0.0 110.179 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.56 107.81 7.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 118.988 -0.529 . . . . 0.0 110.584 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 24.9 m -98.4 157.5 16.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 123.147 0.579 . . . . 0.0 111.94 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.1 t -106.0 138.08 33.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 110.9 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.6 m95 . . . . . 0 N--CA 1.467 0.378 0 N-CA-C 114.881 1.438 . . . . 0.0 114.881 176.427 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 . . . . . 0 N--CA 1.471 0.601 0 CA-C-O 121.436 0.636 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -54.82 -58.77 6.23 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.303 -0.873 . . . . 0.0 111.348 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.2 p -58.01 -33.46 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 m -63.12 -28.57 70.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.217 1.007 . . . . 0.0 111.077 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.4 mmmp? -96.57 -10.59 26.89 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 173.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.52 36.73 7.86 Favored Glycine 0 CA--C 1.52 0.404 0 CA-C-O 118.488 -1.173 . . . . 0.0 112.097 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -97.41 165.44 12.01 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.763 1.282 . . . . 0.0 111.786 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.86 131.69 10.09 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 111.273 -0.731 . . . . 0.0 111.273 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.8 m -79.4 123.74 27.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 O-C-N 122.085 -0.656 . . . . 0.0 110.791 176.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.9 mt -138.62 155.01 73.7 Favored Pre-proline 0 C--O 1.218 -0.602 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.725 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -63.77 139.79 70.7 Favored 'Trans proline' 0 C--O 1.219 -0.44 0 C-N-CA 124.333 3.355 . . . . 0.0 110.488 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -51.62 -26.98 9.95 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 176.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 m -65.57 -46.81 78.05 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.893 0.877 . . . . 0.0 113.155 170.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -75.97 -36.59 59.2 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.509 0.723 . . . . 0.0 112.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.4 t -89.24 121.37 69.52 Favored Pre-proline 0 C--O 1.241 0.632 0 O-C-N 121.089 -1.007 . . . . 0.0 111.823 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -62.96 146.96 95.03 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.651 2.234 . . . . 0.0 110.545 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -52.05 -19.72 2.04 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.91 -32.54 27.21 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.637 1.175 . . . . 0.0 113.052 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.81 -20.58 25.89 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.078 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 60.0 mtt180 -55.24 119.27 5.28 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.429 0.692 . . . . 0.0 110.078 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.0 mt -102.71 175.92 5.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.791 0.805 . . . . 0.0 110.272 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.3 29.85 7.55 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.26 1.024 . . . . 0.0 111.593 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -67.93 -18.36 64.74 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 121.341 -0.849 . . . . 0.0 111.914 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.89 49.97 67.26 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 120.734 -1.229 . . . . 0.0 112.441 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -142.7 33.65 1.85 Allowed Glycine 0 C--O 1.225 -0.458 0 CA-C-O 118.032 -1.427 . . . . 0.0 113.5 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -142.44 150.54 40.72 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.107 0.963 . . . . 0.0 111.777 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.1 m -58.67 -45.56 89.12 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 123.765 0.666 . . . . 0.0 111.416 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 58.4 p -105.66 -75.79 0.62 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.222 0.609 . . . . 0.0 109.594 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.7 p -148.16 148.0 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 126.014 1.726 . . . . 0.0 110.49 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.85 131.34 35.85 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.127 -0.983 . . . . 0.0 110.891 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.22 139.11 45.73 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.384 1.074 . . . . 0.0 111.737 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -81.09 101.2 9.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.808 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.47 -19.42 64.72 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.246 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 N--CA 1.472 0.65 0 CA-C-N 120.105 1.32 . . . . 0.0 112.336 176.081 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt . . . . . 0 C--O 1.221 -0.43 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.1 -39.3 63.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.889 0.757 . . . . 0.0 113.083 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.0 mttm -79.31 11.92 2.66 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.444 1.098 . . . . 0.0 113.487 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.8 39.43 96.76 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.171 0.891 . . . . 0.0 112.292 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.69 172.17 46.07 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 121.954 0.752 . . . . 0.0 112.376 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -136.16 150.1 48.91 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 123.012 1.386 . . . . 0.0 112.434 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.5 t -79.17 135.69 36.88 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 120.753 -1.217 . . . . 0.0 111.662 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -133.28 148.06 67.51 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 124.061 0.944 . . . . 0.0 111.23 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.94 159.13 54.29 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.657 2.238 . . . . 0.0 110.896 177.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 28.7 mt -61.92 -16.73 53.08 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -84.61 -13.51 51.42 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 123.617 1.675 . . . . 0.0 111.963 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -92.83 130.59 38.39 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 118.783 -2.448 . . . . 0.0 110.246 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -85.12 121.55 28.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.333 176.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.496 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 1.8 t -162.1 176.44 10.69 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.903 0.881 . . . . 0.0 110.688 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.3 ttmt -94.87 108.25 20.28 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.04 0.936 . . . . 0.0 111.611 175.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.83 132.04 53.38 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.766 1.226 . . . . 0.0 111.094 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.6 tp -77.69 137.7 38.65 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.009 -1.057 . . . . 0.0 109.593 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -53.34 -40.15 64.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.754 -1.216 . . . . 0.0 113.521 173.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.66 -24.19 63.58 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.878 0.871 . . . . 0.0 111.828 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -88.98 -31.06 18.31 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.467 1.107 . . . . 0.0 112.596 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 51.6 p -53.83 -28.04 33.28 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.828 1.251 . . . . 0.0 112.024 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.46 74.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.391 1.076 . . . . 0.0 112.332 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 m -56.93 -56.94 15.18 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.862 1.265 . . . . 0.0 111.307 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.33 -43.78 96.1 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.02 171.74 19.49 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 122.917 1.287 . . . . 0.0 112.271 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -56.58 135.41 54.71 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.464 -1.021 . . . . 0.0 110.764 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 86.28 9.87 75.45 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.852 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -144.56 169.05 18.71 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 110.795 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -131.77 156.62 45.66 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.558 1.543 . . . . 0.0 110.878 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.9 t -121.3 95.23 4.6 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.218 0.607 . . . . 0.0 111.545 -178.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.1 t -83.65 162.95 20.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -115.34 144.66 22.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 124.621 1.168 . . . . 0.0 111.213 174.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.496 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 33.3 m95 . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 122.28 1.038 . . . . 0.0 112.586 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 . . . . . 0 N--CA 1.476 0.834 0 CA-C-O 122.064 0.935 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.463 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 61.5 m -57.38 -55.27 36.93 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 120.546 -1.346 . . . . 0.0 110.83 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -59.31 -29.65 42.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 122.606 0.363 . . . . 0.0 111.913 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -70.44 -27.88 64.59 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.687 0.795 . . . . 0.0 111.119 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.466 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 22.4 mmmt -95.5 -3.64 46.32 Favored 'General case' 0 C--N 1.338 0.106 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.7 42.25 11.64 Favored Glycine 0 C--O 1.225 -0.463 0 O-C-N 124.348 1.03 . . . . 0.0 111.323 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.458 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 38.3 m-85 -106.36 162.31 13.8 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 124.254 1.021 . . . . 0.0 111.581 176.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.49 140.68 16.21 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.879 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.9 m -79.97 117.11 20.52 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 122.885 0.474 . . . . 0.0 111.398 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 53.2 mt -132.35 154.43 81.59 Favored Pre-proline 0 C--O 1.214 -0.791 0 O-C-N 123.576 0.547 . . . . 0.0 111.722 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -64.54 140.96 71.44 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 123.794 2.996 . . . . 0.0 110.622 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -51.2 -25.48 5.53 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 177.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 91.3 p -68.8 -46.91 67.43 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 171.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -72.64 -34.51 67.34 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.886 0.874 . . . . 0.0 111.911 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.6 t -92.84 126.65 50.82 Favored Pre-proline 0 CA--C 1.539 0.55 0 O-C-N 120.884 -1.135 . . . . 0.0 111.917 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -63.82 147.36 92.32 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.609 2.206 . . . . 0.0 110.671 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -19.53 3.71 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 172.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -81.73 -31.82 31.85 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 123.893 0.877 . . . . 0.0 112.197 175.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.89 -24.62 23.59 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -45.97 117.56 1.56 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.619 0.768 . . . . 0.0 110.376 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.7 mt -103.22 174.61 5.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.337 1.065 . . . . 0.0 109.995 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -128.1 31.46 5.07 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.732 0.813 . . . . 0.0 111.177 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.466 ' CE1' ' HG3' ' A' ' 6' ' ' LYS . 33.0 m-85 -69.0 -17.53 63.93 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 121.226 -0.921 . . . . 0.0 112.065 177.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.36 88.03 0.05 OUTLIER Glycine 0 CA--C 1.532 1.104 0 CA-C-O 124.51 2.172 . . . . 0.0 111.857 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.24 25.97 0.03 OUTLIER Glycine 0 C--O 1.224 -0.506 0 O-C-N 119.909 -1.936 . . . . 0.0 113.652 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 67.7 m -137.24 149.79 47.4 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 123.415 0.686 . . . . 0.0 111.454 177.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -61.86 -42.6 99.24 Favored 'General case' 0 C--O 1.222 -0.371 0 O-C-N 124.364 1.04 . . . . 0.0 111.291 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.5 p -107.67 -75.19 0.64 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.395 0.678 . . . . 0.0 110.245 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.4 p -151.05 143.6 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.919 1.343 . . . . 0.0 111.06 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 91.9 m -82.0 124.17 29.55 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.279 -1.513 . . . . 0.0 110.259 173.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.89 142.99 33.44 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 122.315 1.055 . . . . 0.0 111.407 174.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.458 ' HA ' ' CD1' ' A' ' 8' ' ' PHE . 1.9 p30 -81.03 100.71 9.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 124.247 1.975 . . . . 0.0 113.731 177.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 mt -65.89 -27.84 68.5 Favored 'General case' 0 C--O 1.218 -0.557 0 O-C-N 118.733 -2.479 . . . . 0.0 111.723 -178.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.1 t . . . . . 0 N--CA 1.466 0.348 0 C-N-CA 124.3 1.04 . . . . 0.0 112.888 177.149 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.3 mttt . . . . . 0 C--O 1.222 -0.349 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.41 -34.22 33.71 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.524 0.583 . . . . 0.0 113.958 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.6 mmtt -85.68 15.28 4.82 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.198 1.399 . . . . 0.0 113.024 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.72 36.89 93.93 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 123.735 0.683 . . . . 0.0 112.243 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.82 177.49 21.88 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 121.876 0.709 . . . . 0.0 112.192 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -142.28 152.77 43.33 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.7 1.238 . . . . 0.0 111.819 178.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.9 t -66.49 128.77 37.5 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 111.948 175.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -125.23 148.0 59.23 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 122.284 1.04 . . . . 0.0 111.793 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.04 156.23 65.86 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.287 1.992 . . . . 0.0 111.147 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.408 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 9.7 mt -65.16 -18.07 65.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 176.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -85.4 -9.6 57.33 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.402 0.681 . . . . 0.0 112.09 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -93.36 131.21 38.73 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 120.871 -1.143 . . . . 0.0 110.052 176.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -78.8 121.71 25.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.27 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.4 t -168.34 174.56 6.93 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 123.916 0.886 . . . . 0.0 110.055 176.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -92.51 124.45 36.55 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.458 1.103 . . . . 0.0 111.127 173.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -125.91 131.8 52.25 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 125.686 1.594 . . . . 0.0 110.687 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 12.3 tp -91.21 135.22 33.94 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.562 -0.711 . . . . 0.0 109.808 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -51.0 -40.25 57.7 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 175.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.01 64.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.142 0.977 . . . . 0.0 111.863 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -95.93 -33.53 12.15 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.67 1.188 . . . . 0.0 110.428 -178.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.1 m -53.53 -30.6 42.46 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.185 0.994 . . . . 0.0 111.37 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.87 63.42 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.82 0.848 . . . . 0.0 112.937 174.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.5 t -58.01 -58.05 10.11 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.705 0.802 . . . . 0.0 111.378 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 97.9 m -71.69 -47.25 55.42 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.964 0.412 . . . . 0.0 111.559 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -150.51 18.51 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-O 123.36 1.533 . . . . 0.0 112.38 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -78.29 145.52 35.33 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 120.249 -1.736 . . . . 0.0 111.354 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.71 0.63 85.16 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 119.31 -0.717 . . . . 0.0 113.544 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -149.21 149.31 30.77 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.219 1.007 . . . . 0.0 110.713 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.408 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -132.09 138.86 48.3 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.472 0.709 . . . . 0.0 110.29 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.5 t -77.59 131.45 37.83 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.877 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.515 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.1 OUTLIER -120.25 150.62 40.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 119.676 1.125 . . . . 0.0 110.386 177.333 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.41 141.31 46.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 123.555 0.742 . . . . 0.0 110.308 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.515 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 11.7 m95 . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 122.023 0.916 . . . . 0.0 111.975 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 . . . . . 0 N--CA 1.468 0.433 0 CA-C-O 120.473 0.178 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.7 m -51.97 -55.97 17.12 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 121.136 -0.977 . . . . 0.0 111.136 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.6 p -56.93 -34.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 175.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.0 t -63.02 -27.17 69.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.068 1.347 . . . . 0.0 112.409 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -96.74 -9.7 28.39 Favored 'General case' 0 C--N 1.34 0.176 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 171.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 85.89 29.66 25.49 Favored Glycine 0 CA--C 1.525 0.668 0 CA-C-O 117.826 -1.541 . . . . 0.0 112.989 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -88.81 168.88 12.09 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.065 1.433 . . . . 0.0 113.194 175.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.42 129.79 8.64 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.494 1.045 . . . . 0.0 111.623 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.2 m -77.16 132.4 38.78 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.053 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.3 mt -142.59 162.68 43.2 Favored Pre-proline 0 N--CA 1.469 0.513 0 O-C-N 124.327 1.017 . . . . 0.0 111.152 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -70.48 140.92 41.06 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.536 2.157 . . . . 0.0 111.127 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -55.4 -20.86 13.39 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.1 t -67.63 -48.47 66.64 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.902 1.281 . . . . 0.0 113.444 169.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -73.58 -44.68 56.7 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-O 123.173 1.463 . . . . 0.0 112.18 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.8 t -79.34 116.63 61.94 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 119.851 -1.78 . . . . 0.0 112.874 -178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.67 154.12 71.08 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.012 1.808 . . . . 0.0 111.918 -177.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -28.4 22.22 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -81.68 -18.96 42.67 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.624 1.97 . . . . 0.0 113.114 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.71 -21.72 17.42 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 116.206 -1.854 . . . . 0.0 113.098 172.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -54.91 111.78 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.192 1.36 . . . . 0.0 111.335 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.6 mt -94.8 174.61 7.02 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.713 0.768 . . . . 0.0 109.921 -178.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.2 m -118.24 25.49 10.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.921 1.288 . . . . 0.0 112.675 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -66.03 -20.81 66.3 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-O 117.701 -1.143 . . . . 0.0 112.151 174.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.9 73.25 0.45 Allowed Glycine 0 N--CA 1.476 1.308 0 CA-C-N 121.107 1.776 . . . . 0.0 112.667 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -177.38 29.02 0.07 OUTLIER Glycine 0 C--O 1.23 -0.132 0 O-C-N 120.674 -1.486 . . . . 0.0 113.266 -174.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.6 m -129.58 157.75 41.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.631 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.0 t -44.19 -47.28 9.17 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.067 1.479 . . . . 0.0 112.664 -177.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -131.49 -59.3 0.97 Allowed 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.322 1.449 . . . . 0.0 110.21 177.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.4 p -140.33 153.3 21.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 122.676 1.227 . . . . 0.0 110.919 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.4 t -93.78 137.02 33.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.101 174.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -113.17 140.09 48.21 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 122.509 1.147 . . . . 0.0 112.523 176.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -81.09 101.25 9.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.79 -1.095 . . . . 0.0 111.523 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -62.64 -37.92 88.24 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.644 -1.17 . . . . 0.0 112.127 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.474 0.767 0 C-N-CA 125.361 1.464 . . . . 0.0 112.414 178.138 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt . . . . . 0 C--O 1.225 -0.191 0 CA-C-O 118.058 -0.972 . . . . 0.0 112.76 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.35 54.84 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.98 1.276 . . . . 0.0 114.216 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -81.78 12.29 4.11 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.766 1.626 . . . . 0.0 114.28 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.5 22.26 76.44 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.785 1.183 . . . . 0.0 114.49 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.96 -175.81 30.63 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.506 1.051 . . . . 0.0 112.626 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.13 149.65 29.73 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.227 1.011 . . . . 0.0 111.504 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.29 130.59 47.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 120.998 -1.064 . . . . 0.0 112.442 172.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -128.46 151.89 77.41 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.75 0.82 . . . . 0.0 111.435 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.03 153.63 67.47 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.506 2.137 . . . . 0.0 110.616 176.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.98 -20.46 62.44 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -73.93 -18.92 60.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.511 1.524 . . . . 0.0 113.399 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -86.72 129.57 34.82 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 120.512 -1.367 . . . . 0.0 109.834 174.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -79.64 125.37 29.53 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.94 170.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.36 174.15 3.96 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.4 1.08 . . . . 0.0 110.703 175.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -86.54 124.26 32.64 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.208 1.003 . . . . 0.0 110.451 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -124.33 139.03 54.29 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.097 1.498 . . . . 0.0 112.09 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.89 148.98 22.83 Favored 'General case' 0 C--O 1.22 -0.485 0 O-C-N 120.801 -1.187 . . . . 0.0 109.645 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -64.15 -40.05 95.32 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.399 -0.813 . . . . 0.0 112.369 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.79 -32.55 59.93 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.61 -36.73 28.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.612 -0.68 . . . . 0.0 112.72 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.2 m -54.38 -29.42 48.57 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.116 1.367 . . . . 0.0 112.26 175.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.14 86.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 117.963 -1.018 . . . . 0.0 112.94 174.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t -44.13 -58.04 3.07 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.791 2.037 . . . . 0.0 112.074 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -80.36 -56.2 4.36 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.878 172.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 42.57 -147.54 0.64 Allowed Glycine 0 C--N 1.35 1.326 0 C-N-CA 127.247 2.356 . . . . 0.0 112.353 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt 49.09 46.47 22.61 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 119.837 1.819 . . . . 0.0 114.277 174.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.77 23.0 62.91 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 121.266 -0.896 . . . . 0.0 114.201 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -132.24 159.47 38.96 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 126.379 1.872 . . . . 0.0 110.086 177.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -137.98 124.33 20.6 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 126.439 1.895 . . . . 0.0 109.835 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.53 125.94 28.24 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.517 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.1 m -120.08 137.79 53.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 120.055 1.298 . . . . 0.0 111.798 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.1 p -106.79 144.52 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 122.12 0.962 . . . . 0.0 110.395 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.6 m95 . . . . . 0 CA--C 1.539 0.536 0 C-N-CA 124.82 1.248 . . . . 0.0 111.956 172.142 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.47 0.575 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.2 m -47.86 -54.95 10.94 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.07 -1.019 . . . . 0.0 111.863 173.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 p -57.41 -34.09 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.065 1.346 . . . . 0.0 112.795 176.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 t -64.5 -29.48 70.52 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.33 1.452 . . . . 0.0 111.73 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -94.37 -3.55 50.12 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 172.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 78.01 35.26 35.31 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-N 118.797 0.726 . . . . 0.0 113.073 -176.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.486 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 39.0 m-85 -99.19 166.3 11.3 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.949 1.3 . . . . 0.0 112.466 173.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 143.62 17.53 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.255 0.931 . . . . 0.0 111.308 179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.82 131.38 35.26 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.724 -0.868 . . . . 0.0 110.861 174.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -141.51 156.84 66.61 Favored Pre-proline 0 N--CA 1.471 0.589 0 C-N-CA 123.536 0.734 . . . . 0.0 111.144 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.69 139.28 62.61 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.731 2.287 . . . . 0.0 110.727 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -53.28 -18.84 2.68 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 175.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -71.31 -47.11 58.7 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.415 1.886 . . . . 0.0 111.902 170.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.69 -36.07 44.16 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.573 1.149 . . . . 0.0 111.993 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.7 t -88.17 112.03 46.86 Favored Pre-proline 0 C--O 1.246 0.869 0 C-N-CA 123.878 0.871 . . . . 0.0 111.668 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.91 153.96 64.79 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 123.033 2.489 . . . . 0.0 110.937 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -50.47 -35.07 27.34 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.026 -1.046 . . . . 0.0 113.798 175.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -71.1 -20.76 62.3 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.341 1.056 . . . . 0.0 113.378 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.85 -19.21 16.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.372 1.869 . . . . 0.0 114.656 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -61.17 115.54 3.87 Favored 'General case' 0 CA--C 1.522 -0.104 0 O-C-N 121.25 -0.906 . . . . 0.0 109.982 173.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.9 mt -100.64 166.78 10.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.721 0.772 . . . . 0.0 110.846 178.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.32 27.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.811 1.244 . . . . 0.0 112.573 177.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -65.46 -22.47 66.75 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.117 -0.989 . . . . 0.0 112.666 175.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.61 76.95 0.2 Allowed Glycine 0 CA--C 1.532 1.096 0 CA-C-N 120.025 1.284 . . . . 0.0 113.696 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -175.25 31.63 0.09 OUTLIER Glycine 0 N--CA 1.464 0.501 0 O-C-N 121.141 -1.211 . . . . 0.0 113.324 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.7 m -136.98 148.24 46.79 Favored 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 124.198 0.999 . . . . 0.0 111.272 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.9 m -58.65 -41.92 87.16 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.799 0.84 . . . . 0.0 112.053 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 p -109.55 -75.19 0.63 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.401 1.08 . . . . 0.0 109.069 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 p -147.18 149.11 15.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 126.337 1.855 . . . . 0.0 109.687 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.9 t -76.98 128.13 33.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.636 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -114.36 131.45 56.55 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.403 1.081 . . . . 0.0 111.25 177.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.486 ' HA ' ' CD1' ' A' ' 8' ' ' PHE . 1.5 p30 -84.58 97.7 9.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 124.186 1.946 . . . . 0.0 113.219 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.0 mt -54.67 -35.53 63.63 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.161 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.1 m . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.583 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 54.1 mttt . . . . . 0 N--CA 1.466 0.352 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.28 -41.88 87.72 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.961 0.791 . . . . 0.0 113.765 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -83.92 16.55 2.77 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.644 1.578 . . . . 0.0 114.069 174.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.19 42.19 76.92 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.465 1.031 . . . . 0.0 114.499 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -123.08 175.06 16.56 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.043 1.782 . . . . 0.0 113.925 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -150.66 149.03 29.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.993 1.317 . . . . 0.0 111.048 -175.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -65.84 123.0 18.6 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.119 -0.988 . . . . 0.0 111.483 173.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -127.34 148.22 65.36 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 124.636 1.175 . . . . 0.0 111.22 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -68.02 157.07 63.4 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.458 2.105 . . . . 0.0 111.125 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -62.07 -21.89 65.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -75.22 -13.07 60.41 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.255 2.222 . . . . 0.0 113.008 173.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.51 126.76 35.41 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 119.749 -1.845 . . . . 0.0 110.269 174.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -78.29 117.6 19.7 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.798 0.839 . . . . 0.0 110.076 171.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.2 t -163.06 176.87 9.64 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.333 1.453 . . . . 0.0 109.553 171.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -91.42 106.85 18.79 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 125.505 1.522 . . . . 0.0 110.147 172.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -101.3 141.94 33.44 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.037 0.922 . . . . 0.0 111.196 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 16.7 tp -89.98 134.84 34.0 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.071 -1.018 . . . . 0.0 109.526 170.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 pm0 -48.85 -44.93 40.08 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.079 1.352 . . . . 0.0 112.381 172.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.35 -23.64 64.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.715 1.206 . . . . 0.0 112.752 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -90.4 -39.02 12.92 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.947 1.299 . . . . 0.0 112.935 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.1 p -54.21 -28.5 41.29 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.936 -1.103 . . . . 0.0 112.603 173.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.78 -36.42 69.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.462 1.505 . . . . 0.0 113.157 175.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.3 m -70.63 -48.52 54.58 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.603 1.161 . . . . 0.0 113.281 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 17.3 m -62.29 -40.03 94.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.14 -176.35 25.63 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 122.616 1.12 . . . . 0.0 112.859 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -63.95 143.24 58.01 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.988 -1.301 . . . . 0.0 111.571 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.06 10.62 85.98 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 119.133 -0.815 . . . . 0.0 114.385 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -137.15 160.59 38.55 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.624 1.57 . . . . 0.0 110.694 177.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -137.83 117.32 12.91 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.312 1.845 . . . . 0.0 110.543 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.0 t -74.73 97.59 3.27 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.815 -0.553 . . . . 0.0 110.967 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -77.31 161.67 27.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.605 1.562 . . . . 0.0 110.821 173.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.7 t -123.67 134.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.035 1.334 . . . . 0.0 109.745 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 24.0 m95 . . . . . 0 N--CA 1.463 0.221 0 C-N-CA 124.353 1.061 . . . . 0.0 112.065 178.405 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 . . . . . 0 C--O 1.22 -0.475 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.4 m -47.8 -55.92 8.58 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.658 -0.651 . . . . 0.0 111.284 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.5 p -58.91 -31.06 44.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.017 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.1 t -63.72 -30.12 71.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.727 0.811 . . . . 0.0 110.544 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.485 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 27.0 mmtt -96.18 -9.23 31.03 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.26 29.17 25.79 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 119.195 -0.78 . . . . 0.0 111.906 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 61.8 m-85 -89.75 168.74 11.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 118.331 1.065 . . . . 0.0 111.715 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.66 126.66 6.92 Favored Glycine 0 CA--C 1.519 0.306 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.546 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.0 m -75.78 139.43 41.8 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.95 -0.735 . . . . 0.0 111.076 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.5 mt -154.99 155.0 29.78 Favored Pre-proline 0 C--O 1.206 -1.202 0 O-C-N 124.19 0.931 . . . . 0.0 112.051 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.06 133.95 30.4 Favored 'Trans proline' 0 CA--C 1.506 -0.916 0 C-N-CA 123.98 3.12 . . . . 0.0 111.116 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.411 ' CG ' HG13 ' A' ' 30' ' ' VAL . 63.2 mt-30 -47.34 -27.83 1.77 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 123.191 0.596 . . . . 0.0 111.397 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.6 p -59.73 -47.43 85.7 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -83.12 -30.89 27.55 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.338 0.59 . . . . 0.0 112.46 177.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 17.7 t -93.19 126.63 50.1 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 121.71 -0.619 . . . . 0.0 111.694 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.409 ' HG2' ' CB ' ' A' ' 20' ' ' ALA . 50.0 Cg_endo -67.49 153.01 77.81 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.855 2.37 . . . . 0.0 112.265 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -52.91 -35.08 57.72 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -73.23 -16.34 61.41 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 123.927 0.891 . . . . 0.0 111.13 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.409 ' CB ' ' HG2' ' A' ' 17' ' ' PRO . . . -95.29 -30.26 14.05 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 124.072 0.858 . . . . 0.0 113.052 177.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -54.27 113.01 1.1 Allowed 'General case' 0 C--N 1.334 -0.069 0 O-C-N 121.584 -0.698 . . . . 0.0 110.07 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 13.0 mt -96.33 177.92 5.54 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.776 0.798 . . . . 0.0 110.2 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.8 p -122.38 34.58 5.11 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.385 0.674 . . . . 0.0 111.391 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.443 ' CZ ' ' CE2' ' A' ' 8' ' ' PHE . 59.1 m-85 -73.82 -16.87 61.13 Favored 'General case' 0 C--O 1.203 -1.379 0 O-C-N 122.092 -0.38 . . . . 0.0 110.84 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.6 80.99 0.07 OUTLIER Glycine 0 C--O 1.219 -0.839 0 CA-C-O 122.439 1.021 . . . . 0.0 111.905 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.2 26.07 0.04 OUTLIER Glycine 0 C--O 1.223 -0.538 0 O-C-N 120.796 -1.414 . . . . 0.0 112.795 -179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 56.2 m -124.44 156.98 36.27 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 117.02 0.41 . . . . 0.0 111.533 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -48.9 -44.73 40.43 Favored 'General case' 0 C--O 1.223 -0.338 0 O-C-N 123.923 0.765 . . . . 0.0 111.122 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.2 t -132.34 -60.3 0.9 Allowed 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.601 0.76 . . . . 0.0 110.965 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.411 HG13 ' CG ' ' A' ' 13' ' ' GLN . 13.9 p -145.35 140.29 22.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 CA-C-O 121.847 0.832 . . . . 0.0 110.988 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 1.3 t -82.63 140.57 33.1 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.291 -0.88 . . . . 0.0 111.969 176.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -116.19 130.07 56.61 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.835 1.302 . . . . 0.0 110.742 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.16 106.39 7.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 123.128 1.442 . . . . 0.0 112.146 177.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mt -64.94 -37.7 88.53 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 119.271 -2.143 . . . . 0.0 110.182 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 CA--C 1.528 0.123 0 O-C-N 121.803 -0.56 . . . . 0.0 112.05 178.844 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt . . . . . 0 C--O 1.222 -0.381 0 CA-C-O 121.516 0.674 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -69.42 -36.19 77.3 Favored Glycine 0 C--N 1.336 0.544 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.0 mttt -78.61 12.67 1.94 Allowed 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.58 42.08 14.63 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.788 -0.525 . . . . 0.0 111.788 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -115.65 169.39 12.91 Favored Glycine 0 CA--C 1.518 0.244 0 CA-C-N 117.033 0.417 . . . . 0.0 112.774 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -149.74 155.91 40.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.833 0.825 . . . . 0.0 112.127 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 t -73.71 130.8 40.73 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.102 -0.999 . . . . 0.0 112.456 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -135.76 148.44 65.35 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 121.598 0.713 . . . . 0.0 112.063 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.18 159.22 54.08 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.506 2.138 . . . . 0.0 111.508 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.431 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 14.4 mt -60.96 -15.84 35.92 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.55 -10.63 57.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.058 0.543 . . . . 0.0 111.455 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.46 129.15 41.34 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 121.775 0.798 . . . . 0.0 109.877 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -80.45 120.51 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.715 176.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -172.83 170.53 4.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.456 0.646 . . . . 0.0 111.169 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 tttt -83.08 111.13 18.6 Favored 'General case' 0 CA--C 1.522 -0.121 0 O-C-N 121.859 -0.525 . . . . 0.0 110.456 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -117.87 128.96 55.34 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.746 0.784 . . . . 0.0 111.293 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.7 mt -84.82 156.39 21.35 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.589 -0.694 . . . . 0.0 110.636 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -69.61 -33.95 73.39 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.351 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.47 -31.05 33.17 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 120.82 0.343 . . . . 0.0 111.813 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -80.45 -30.98 37.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.983 0.42 . . . . 0.0 111.007 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 93.6 p -55.31 -37.87 67.93 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.628 -0.67 . . . . 0.0 111.588 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.96 -36.69 72.92 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 123.525 0.516 . . . . 0.0 112.074 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.0 t -54.42 -54.37 41.69 Favored 'General case' 0 C--N 1.334 -0.108 0 O-C-N 123.411 0.444 . . . . 0.0 111.474 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 8.8 m -57.06 -49.97 74.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.377 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 116.21 175.6 17.92 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-O 122.496 1.053 . . . . 0.0 112.067 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -61.4 129.24 40.25 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.329 -1.101 . . . . 0.0 110.436 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.36 6.58 70.79 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 113.483 -179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -141.93 162.5 35.31 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.395 0.617 . . . . 0.0 110.951 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.431 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 64.5 mmtt -138.49 138.75 38.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 122.133 0.968 . . . . 0.0 111.93 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -84.49 106.04 15.76 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.583 -0.698 . . . . 0.0 110.672 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.33 156.17 21.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.674 0.75 . . . . 0.0 111.795 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.12 144.65 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 C-N-CA 123.226 0.61 . . . . 0.0 111.18 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 57.9 m95 . . . . . 0 C--N 1.326 -0.442 0 CA-C-O 121.541 0.686 . . . . 0.0 111.853 176.374 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.472 0.668 0 CA-C-O 120.582 0.229 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.2 m -53.67 -48.24 69.65 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.513 -1.367 . . . . 0.0 111.829 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -56.43 -27.1 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.552 1.141 . . . . 0.0 113.187 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 t -66.8 -35.19 79.49 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.875 1.27 . . . . 0.0 111.287 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.42 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 3.6 mmmm -96.9 -7.65 32.79 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 174.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.25 44.35 7.05 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.203 0.906 . . . . 0.0 112.396 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.42 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 35.6 m-85 -108.65 163.31 13.36 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.091 1.356 . . . . 0.0 112.169 176.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.77 145.29 18.4 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.276 0.941 . . . . 0.0 111.382 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.5 m -83.13 136.3 34.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.7 -0.883 . . . . 0.0 112.025 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.1 mt -148.6 155.83 41.8 Favored Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.738 0.815 . . . . 0.0 111.857 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.53 142.69 79.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.431 2.087 . . . . 0.0 110.884 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -52.54 -21.18 3.54 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 175.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 t -74.17 -46.96 38.92 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.102 1.761 . . . . 0.0 112.868 170.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -68.37 -50.27 54.28 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.276 1.03 . . . . 0.0 110.775 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.53 118.21 70.55 Favored Pre-proline 0 C--O 1.246 0.88 0 O-C-N 121.566 -0.709 . . . . 0.0 111.535 -174.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.02 151.06 86.67 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.793 2.329 . . . . 0.0 110.847 -177.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -52.33 -24.32 7.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -79.55 -28.73 41.21 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.367 1.467 . . . . 0.0 113.989 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -24.47 22.4 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.562 1.145 . . . . 0.0 111.206 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -48.32 117.99 2.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.412 0.685 . . . . 0.0 110.885 174.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 19.5 mt -99.77 172.08 7.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.923 0.868 . . . . 0.0 110.455 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.6 p -100.65 11.29 39.83 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.848 1.659 . . . . 0.0 112.985 177.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.418 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 54.4 m-85 -77.44 -11.74 59.88 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.133 -0.98 . . . . 0.0 112.2 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.72 -106.23 0.57 Allowed Glycine 0 C--O 1.216 -1.0 0 CA-C-O 116.771 -2.127 . . . . 0.0 110.176 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 39.48 28.04 0.1 Allowed Glycine 0 N--CA 1.474 1.21 0 C-N-CA 127.342 2.401 . . . . 0.0 115.419 175.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.0 m -145.67 146.71 31.4 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.441 1.496 . . . . 0.0 108.972 -169.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 m -68.66 -22.71 64.38 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 p -127.0 -75.86 0.58 Allowed 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 125.943 1.697 . . . . 0.0 110.659 -175.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -148.58 150.44 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 O-C-N 121.312 -0.868 . . . . 0.0 110.863 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 t -78.77 129.44 34.64 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 121.516 -0.74 . . . . 0.0 110.354 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.83 140.21 46.67 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.245 1.022 . . . . 0.0 112.964 177.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -88.98 104.31 16.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.262 1.029 . . . . 0.0 110.987 -178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.7 mt -58.37 -33.11 69.21 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.022 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 125.122 1.369 . . . . 0.0 111.868 178.065 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt . . . . . 0 C--O 1.223 -0.291 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.194 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.99 -42.85 54.94 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 124.157 0.884 . . . . 0.0 113.601 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.529 ' HE3' ' OE1' ' A' ' 60' ' ' GLU . 7.6 mtmp? -78.99 15.44 1.11 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.033 1.733 . . . . 0.0 113.928 173.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.11 32.67 83.21 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.251 1.881 . . . . 0.0 114.42 -176.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -97.14 170.99 26.52 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-O 122.779 1.211 . . . . 0.0 113.417 177.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.2 tt0 -138.93 150.07 45.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.148 1.379 . . . . 0.0 111.756 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 90.5 m -71.87 120.25 17.2 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 120.754 -1.216 . . . . 0.0 111.192 173.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -110.52 150.69 42.02 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.307 1.043 . . . . 0.0 110.661 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.04 152.45 76.63 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.635 2.224 . . . . 0.0 111.543 176.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.6 mt -57.59 -24.52 56.77 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -73.76 -19.58 60.74 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.163 1.785 . . . . 0.0 112.862 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -89.18 134.82 33.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 123.08 1.419 . . . . 0.0 110.744 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -96.54 120.73 37.38 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 125.069 1.348 . . . . 0.0 109.439 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.6 p -166.76 170.67 12.19 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.174 1.39 . . . . 0.0 109.953 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -73.62 108.01 6.21 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.624 1.17 . . . . 0.0 109.863 175.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.91 145.58 42.05 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.075 0.95 . . . . 0.0 109.783 174.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.02 139.75 32.56 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.176 0.59 . . . . 0.0 110.326 173.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -63.14 -42.08 99.4 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.599 -0.688 . . . . 0.0 112.525 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.05 76.98 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.592 -0.692 . . . . 0.0 111.991 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.529 ' OE1' ' HE3' ' A' ' 43' ' ' LYS . 3.8 tp10 -85.7 -33.79 21.43 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.395 1.078 . . . . 0.0 113.482 -177.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.7 p -53.11 -34.2 55.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.693 1.597 . . . . 0.0 112.377 173.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.61 -36.18 71.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.38 1.072 . . . . 0.0 111.844 176.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -48.25 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.327 1.051 . . . . 0.0 112.473 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 67.6 m -60.84 -41.97 96.85 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 122.448 0.299 . . . . 0.0 111.693 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 113.37 174.24 18.89 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 122.679 1.155 . . . . 0.0 112.732 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -64.53 129.12 38.65 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.707 0.803 . . . . 0.0 109.76 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.36 13.99 62.69 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-O 117.871 -1.516 . . . . 0.0 113.42 -177.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -139.57 156.36 46.93 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.663 1.585 . . . . 0.0 110.639 176.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -127.04 119.0 25.55 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.253 1.821 . . . . 0.0 110.118 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.2 t -76.04 104.95 6.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.415 -0.803 . . . . 0.0 111.408 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 60.9 m -101.23 161.19 13.79 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.712 0.768 . . . . 0.0 112.058 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.8 m -116.22 145.07 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.604 0.762 . . . . 0.0 110.993 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 71.6 m95 . . . . . 0 N--CA 1.461 0.094 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.402 177.395 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 120.555 0.217 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 97.0 m -51.49 -63.18 1.22 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.275 1.03 . . . . 0.0 111.421 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.6 p -56.59 -34.81 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 112.773 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.5 t -62.64 -26.05 68.43 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.949 1.3 . . . . 0.0 112.422 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.438 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 2.6 mmpt? -99.25 -7.18 26.79 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 171.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.38 28.74 35.33 Favored Glycine 0 CA--C 1.535 1.315 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.377 -175.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -90.54 160.84 15.76 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.672 1.736 . . . . 0.0 113.649 175.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.42 123.83 7.7 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 125.771 1.653 . . . . 0.0 111.797 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -73.85 131.11 41.16 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 121.333 -1.098 . . . . 0.0 111.283 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 70.6 mt -142.19 164.19 35.11 Favored Pre-proline 0 N--CA 1.472 0.649 0 C-N-CA 123.021 0.528 . . . . 0.0 110.583 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.42 141.49 35.19 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.161 1.907 . . . . 0.0 111.656 171.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -51.02 -15.57 0.33 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.864 1.666 . . . . 0.0 115.181 173.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 t -78.27 -39.54 39.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.953 2.101 . . . . 0.0 113.021 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -86.25 -37.1 18.95 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.69 1.596 . . . . 0.0 110.924 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.3 t -92.49 116.33 66.31 Favored Pre-proline 0 C--O 1.245 0.856 0 C-N-CA 124.431 1.092 . . . . 0.0 111.921 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.76 151.22 86.49 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.541 2.161 . . . . 0.0 111.672 -175.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -53.8 -28.71 36.75 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -72.89 -19.7 61.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.697 1.199 . . . . 0.0 113.658 176.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -102.65 -16.08 16.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 128.048 2.539 . . . . 0.0 114.276 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -59.74 105.25 0.36 Allowed 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.254 -0.903 . . . . 0.0 112.2 171.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mt -93.6 163.32 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 111.846 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 p -103.71 22.39 14.5 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.11 1.764 . . . . 0.0 114.407 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -67.79 3.51 1.44 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.964 1.706 . . . . 0.0 115.452 175.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 38.98 64.33 0.93 Allowed Glycine 0 N--CA 1.475 1.261 0 C-N-CA 126.917 2.199 . . . . 0.0 114.876 171.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -165.22 28.17 0.2 Allowed Glycine 0 C--O 1.226 -0.395 0 CA-C-O 118.738 -1.035 . . . . 0.0 113.472 -173.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.6 m -130.42 161.91 30.31 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.6 0.76 . . . . 0.0 112.422 177.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -53.54 -36.34 61.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.508 1.123 . . . . 0.0 113.549 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.29 -50.29 0.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.543 1.137 . . . . 0.0 111.074 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.9 p -147.24 149.29 15.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 122.07 0.938 . . . . 0.0 111.432 174.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.2 t -89.7 137.66 32.14 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 124.355 1.062 . . . . 0.0 108.8 172.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.16 133.18 56.27 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.105 0.962 . . . . 0.0 111.225 177.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -82.36 90.01 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 123.97 1.843 . . . . 0.0 112.679 -177.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -50.31 -33.66 20.91 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.123 1.156 . . . . 0.0 114.123 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 177.823 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.441 ' HE2' ' OE2' ' A' ' 46' ' ' GLU . 34.1 mmtp . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.91 -29.77 62.4 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.116 0.865 . . . . 0.0 115.011 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -87.51 8.22 25.92 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.14 32.78 30.93 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.341 0.972 . . . . 0.0 113.422 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.8 164.03 28.65 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 124.282 0.944 . . . . 0.0 113.332 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.441 ' OE2' ' HE2' ' A' ' 41' ' ' LYS . 8.6 tp10 -152.13 151.8 31.51 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.574 1.15 . . . . 0.0 112.539 178.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 36.4 m -70.19 121.46 17.6 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.874 -1.141 . . . . 0.0 111.369 174.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -121.89 148.25 50.72 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.977 0.911 . . . . 0.0 111.784 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -69.29 155.44 67.48 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.456 2.104 . . . . 0.0 110.697 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.7 mt -60.59 -21.31 62.49 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -74.17 -20.53 60.18 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 128.258 2.623 . . . . 0.0 112.86 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -88.62 119.89 29.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.298 -1.501 . . . . 0.0 110.638 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -63.04 117.67 6.78 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.136 0.574 . . . . 0.0 111.09 168.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.9 t -155.66 -173.1 4.39 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.305 1.042 . . . . 0.0 110.055 166.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -96.84 108.1 20.71 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.201 1.8 . . . . 0.0 110.098 167.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -107.87 147.67 30.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.66 120.36 42.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.402 1.481 . . . . 0.0 110.255 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.434 ' H ' ' NE2' ' A' ' 58' ' ' GLN . 5.7 mp0 -55.36 -34.79 64.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.609 0.764 . . . . 0.0 111.685 -176.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.77 -39.4 65.35 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.693 2.397 . . . . 0.0 113.956 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -105.85 -13.73 15.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.143 1.377 . . . . 0.0 112.386 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -55.83 -37.57 68.87 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.14 -1.6 . . . . 0.0 112.108 174.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.83 -32.0 71.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.54 1.536 . . . . 0.0 113.417 173.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -63.94 -48.96 74.48 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.268 1.427 . . . . 0.0 111.971 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.9 t -67.98 -29.93 69.08 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 175.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.73 176.62 25.89 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-O 122.865 1.258 . . . . 0.0 113.672 176.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -64.68 130.76 44.79 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.841 -1.388 . . . . 0.0 111.822 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.54 4.79 60.56 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.108 0.861 . . . . 0.0 114.054 -178.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -132.82 161.23 34.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.695 1.598 . . . . 0.0 110.594 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -138.17 120.18 15.51 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.046 1.738 . . . . 0.0 110.788 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.2 t -73.25 92.17 1.75 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 122.778 0.431 . . . . 0.0 110.579 177.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.4 t -80.35 160.22 25.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.936 1.694 . . . . 0.0 110.667 177.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.8 p -133.53 143.12 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.134 0.973 . . . . 0.0 111.0 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 36.1 m95 . . . . . 0 CA--C 1.537 0.462 0 C-N-CA 124.32 1.048 . . . . 0.0 110.335 177.936 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 . . . . . 0 N--CA 1.474 0.752 0 CA-C-O 121.3 0.571 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 73.9 m -51.32 -59.26 4.41 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 120.814 -1.179 . . . . 0.0 111.099 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.79 -32.76 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -63.11 -31.83 73.07 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.602 1.161 . . . . 0.0 110.994 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.404 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 1.4 mmpt? -95.09 -11.49 28.17 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.74 -1.124 . . . . 0.0 113.569 174.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.19 33.91 22.04 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 124.157 0.911 . . . . 0.0 112.397 -177.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -80.35 169.17 18.09 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 118.74 1.27 . . . . 0.0 112.342 175.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.84 117.58 4.08 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 123.648 0.642 . . . . 0.0 111.544 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.0 m -72.16 131.92 43.45 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.259 175.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 79.8 mt -147.87 156.39 44.32 Favored Pre-proline 0 C--O 1.218 -0.597 0 O-C-N 124.309 1.006 . . . . 0.0 111.224 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.412 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 56.1 Cg_endo -66.3 139.66 55.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.089 2.526 . . . . 0.0 111.247 175.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -52.22 -20.68 2.78 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.1 t -66.74 -48.13 70.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.948 1.299 . . . . 0.0 112.611 170.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.44 -38.1 42.06 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.157 0.983 . . . . 0.0 111.361 177.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -87.61 125.86 63.81 Favored Pre-proline 0 CA--C 1.541 0.623 0 O-C-N 120.866 -1.146 . . . . 0.0 111.918 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -63.25 146.36 93.81 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.997 2.465 . . . . 0.0 110.691 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -52.2 -20.38 2.58 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.32 -35.76 30.58 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.867 1.667 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.01 -26.47 31.2 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 176.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -44.84 110.65 0.24 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.243 1.017 . . . . 0.0 111.429 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -95.72 175.15 6.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.475 1.131 . . . . 0.0 110.221 -178.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.1 p -127.13 29.23 5.63 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.361 1.064 . . . . 0.0 112.429 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.523 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 9.5 m-85 -71.5 -15.94 62.33 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 121.409 -0.807 . . . . 0.0 111.207 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.14 82.8 0.07 OUTLIER Glycine 0 CA--C 1.53 0.978 0 CA-C-O 124.395 2.108 . . . . 0.0 112.095 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 174.25 32.71 0.03 OUTLIER Glycine 0 C--O 1.227 -0.327 0 O-C-N 120.627 -1.514 . . . . 0.0 113.339 -176.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 19.3 m -131.45 165.98 22.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 122.408 0.283 . . . . 0.0 111.742 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.7 p -54.0 -46.61 71.81 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 124.666 1.229 . . . . 0.0 112.251 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 1.4 t -132.15 -54.84 0.98 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.577 1.151 . . . . 0.0 111.424 -178.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 p -149.82 140.77 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 122.296 1.046 . . . . 0.0 110.605 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 76.6 m -83.2 138.93 33.42 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.904 -1.123 . . . . 0.0 109.98 171.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.1 140.98 48.84 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 122.855 1.312 . . . . 0.0 111.056 173.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -76.29 106.84 8.14 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 124.123 1.916 . . . . 0.0 112.889 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.06 -36.19 81.49 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 119.284 -2.135 . . . . 0.0 110.908 -178.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.5 p . . . . . 0 N--CA 1.467 0.407 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 179.545 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt . . . . . 0 C--O 1.226 -0.178 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.08 -38.32 65.92 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.604 0.621 . . . . 0.0 113.935 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -89.62 16.1 8.4 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.494 1.518 . . . . 0.0 112.882 176.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.69 34.37 87.22 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.147 0.403 . . . . 0.0 112.732 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.94 174.96 32.24 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-O 122.569 1.094 . . . . 0.0 112.111 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.93 136.27 28.41 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 122.424 1.107 . . . . 0.0 112.136 -177.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.5 t -73.53 123.45 23.96 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.899 -1.126 . . . . 0.0 112.488 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -127.28 147.09 60.56 Favored Pre-proline 0 CA--C 1.538 0.501 0 O-C-N 120.639 -1.288 . . . . 0.0 111.088 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -67.25 153.93 75.72 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.33 2.02 . . . . 0.0 110.565 176.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.406 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 13.7 mt -61.18 -18.46 58.31 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.0 -14.99 57.43 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.72 1.208 . . . . 0.0 112.258 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -88.93 139.8 30.09 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.705 -1.247 . . . . 0.0 110.009 175.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -96.7 122.33 39.52 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.841 0.856 . . . . 0.0 110.808 174.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.4 p -167.67 169.81 11.52 Favored 'General case' 0 C--O 1.214 -0.813 0 C-N-CA 123.224 0.61 . . . . 0.0 110.575 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -74.06 111.19 8.98 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.937 -0.477 . . . . 0.0 110.575 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.36 136.07 53.8 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.97 1.308 . . . . 0.0 111.369 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.09 143.6 29.59 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 120.885 -1.134 . . . . 0.0 110.734 176.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.03 -41.87 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.736 0.814 . . . . 0.0 113.089 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.73 -36.15 67.7 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.74 -0.6 . . . . 0.0 111.432 176.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.72 -30.9 51.95 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 121.853 -0.529 . . . . 0.0 111.242 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.4 ' HB2' ' CE ' ' A' ' 69' ' ' LYS . 28.3 p -55.27 -31.34 61.5 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 124.552 1.141 . . . . 0.0 111.722 178.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.93 -34.76 65.92 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 118.058 -0.973 . . . . 0.0 112.813 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.4 t -46.53 -53.08 12.03 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.362 1.465 . . . . 0.0 111.886 177.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 2.2 m -87.21 -56.54 3.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.401 174.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 39.48 -147.03 0.19 Allowed Glycine 0 C--O 1.217 -0.947 0 C-N-CA 125.599 1.571 . . . . 0.0 112.094 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 77.8 mttt 47.42 46.37 17.25 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.052 1.426 . . . . 0.0 113.909 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.63 19.8 65.21 Favored Glycine 0 CA--C 1.534 1.245 0 N-CA-C 114.241 0.456 . . . . 0.0 114.241 -174.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -139.23 150.98 46.16 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.941 1.696 . . . . 0.0 110.23 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.406 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -121.2 157.89 29.25 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.402 1.081 . . . . 0.0 109.954 178.046 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 50.6 t -101.5 96.28 7.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.652 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 33.8 m -89.67 144.22 26.17 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.16 0.584 . . . . 0.0 111.455 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.7 p -114.44 142.47 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.099 0.96 . . . . 0.0 110.186 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 32.0 m95 . . . . . 0 CA--C 1.517 -0.312 0 C-N-CA 123.627 0.771 . . . . 0.0 112.601 175.668 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 120.414 0.149 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -48.8 -59.28 3.69 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.517 -0.739 . . . . 0.0 111.168 176.197 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.56 -29.01 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.8 t -70.29 -30.03 66.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.442 1.097 . . . . 0.0 111.714 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.2 mmtt -94.4 -10.12 33.52 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 175.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.58 30.69 10.28 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-O 118.486 -1.175 . . . . 0.0 113.172 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -91.29 169.58 10.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.814 1.307 . . . . 0.0 112.062 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -122.33 133.92 9.49 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.102 0.858 . . . . 0.0 111.507 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 68.1 m -81.23 134.85 35.68 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 121.911 -0.758 . . . . 0.0 111.487 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.6 mt -145.76 155.78 52.24 Favored Pre-proline 0 C--O 1.22 -0.463 0 O-C-N 124.066 0.854 . . . . 0.0 111.87 178.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.08 141.8 71.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 123.222 2.615 . . . . 0.0 110.852 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -54.11 -22.18 10.38 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.7 p -69.23 -46.17 68.01 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 125.409 1.483 . . . . 0.0 113.004 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.54 -37.42 56.7 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.991 0.916 . . . . 0.0 111.96 176.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.6 t -89.33 118.75 69.4 Favored Pre-proline 0 C--O 1.243 0.724 0 O-C-N 121.433 -0.792 . . . . 0.0 111.832 -178.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -63.23 150.58 88.2 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.711 2.274 . . . . 0.0 110.833 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -54.27 -20.49 7.18 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -82.81 -24.52 33.31 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.884 1.273 . . . . 0.0 113.815 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -97.26 -19.91 18.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.848 1.659 . . . . 0.0 112.059 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -53.78 118.85 4.28 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 121.063 -1.023 . . . . 0.0 110.558 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.3 mt -103.0 173.85 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.315 1.055 . . . . 0.0 110.519 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.1 p -127.15 28.5 5.74 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 0.0 112.176 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -69.63 -18.15 63.57 Favored 'General case' 0 C--O 1.207 -1.156 0 O-C-N 121.481 -0.762 . . . . 0.0 110.988 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.88 87.32 0.08 OUTLIER Glycine 0 CA--C 1.526 0.726 0 CA-C-O 124.174 1.986 . . . . 0.0 112.032 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.68 31.15 0.03 OUTLIER Glycine 0 C--O 1.221 -0.718 0 O-C-N 120.346 -1.679 . . . . 0.0 113.694 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.406 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 93.3 m -138.83 145.39 40.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.219 0.509 . . . . 0.0 110.488 176.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.3 t -60.81 -40.78 93.97 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 124.156 0.91 . . . . 0.0 111.447 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.7 p -108.65 -73.62 0.68 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.727 1.211 . . . . 0.0 111.066 -177.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.9 p -150.76 148.36 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.864 1.266 . . . . 0.0 110.74 175.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.406 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 m -76.72 136.56 39.07 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 120.948 -1.095 . . . . 0.0 109.964 171.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.45 133.2 55.45 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 125.067 1.347 . . . . 0.0 112.114 175.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.29 100.19 5.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 122.915 1.341 . . . . 0.0 113.46 178.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mt -59.35 -35.3 73.6 Favored 'General case' 0 C--O 1.22 -0.477 0 O-C-N 120.606 -1.309 . . . . 0.0 111.439 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 N--CA 1.467 0.419 0 C-N-CA 123.933 0.893 . . . . 0.0 112.622 178.954 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.4 mttm . . . . . 0 C--O 1.221 -0.418 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -52.28 -30.11 31.58 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-N 118.809 0.731 . . . . 0.0 114.227 178.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -78.46 10.75 2.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.051 1.74 . . . . 0.0 113.45 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.31 35.12 77.09 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.503 1.049 . . . . 0.0 112.624 -175.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -104.64 -176.61 24.92 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-O 122.554 1.085 . . . . 0.0 113.309 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -146.62 150.19 34.98 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 123.167 1.46 . . . . 0.0 111.979 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 85.0 m -73.17 118.25 15.9 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.692 -1.255 . . . . 0.0 111.581 174.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -116.26 146.86 38.23 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.908 0.883 . . . . 0.0 111.011 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.81 153.19 76.32 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.693 2.262 . . . . 0.0 110.665 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.9 mt -59.75 -25.07 64.56 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -72.43 -21.16 61.29 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.608 1.163 . . . . 0.0 112.796 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -92.58 130.66 38.16 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.006 -1.059 . . . . 0.0 110.705 176.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.26 133.04 44.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.946 174.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.493 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 0.6 OUTLIER -168.7 178.45 4.66 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.025 0.53 . . . . 0.0 110.288 174.453 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttt -102.75 105.86 16.37 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 123.755 0.822 . . . . 0.0 110.618 175.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -122.14 137.81 54.69 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.285 1.034 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.56 136.5 36.27 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -48.67 -37.62 19.0 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -78.39 -29.29 47.2 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.788 0.835 . . . . 0.0 112.248 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -81.61 -30.23 32.96 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.503 0.721 . . . . 0.0 111.221 177.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.6 t -57.2 -29.61 63.85 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.427 1.491 . . . . 0.0 111.385 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.7 -33.72 66.73 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.334 1.054 . . . . 0.0 113.387 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.8 t -52.29 -61.03 2.53 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.149 0.979 . . . . 0.0 111.833 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.1 m -75.85 -52.43 10.38 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 37.8 -146.31 0.12 Allowed Glycine 0 C--N 1.344 1.016 0 C-N-CA 126.73 2.109 . . . . 0.0 111.455 -176.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mttp 45.81 43.91 10.35 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 119.944 1.872 . . . . 0.0 114.029 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.73 17.71 74.64 Favored Glycine 0 CA--C 1.539 1.566 0 O-C-N 121.544 -0.722 . . . . 0.0 114.899 -175.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -130.31 150.64 51.45 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.878 2.071 . . . . 0.0 109.612 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -115.78 158.81 22.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.584 1.554 . . . . 0.0 110.365 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 39.9 t -108.08 92.66 4.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.001 0.52 . . . . 0.0 111.041 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 48.7 t -81.96 163.84 21.89 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.774 0.321 . . . . 0.0 111.661 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 p -123.14 144.29 33.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.012 1.325 . . . . 0.0 111.693 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.493 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 46.1 m95 . . . . . 0 CA--C 1.532 0.253 0 C-N-CA 124.507 1.123 . . . . 0.0 111.859 173.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 121.039 0.447 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.476 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 66.8 m -53.69 -54.49 37.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.712 1.205 . . . . 0.0 110.757 175.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -55.83 -38.07 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.052 1.341 . . . . 0.0 113.456 175.414 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.9 m -66.65 -23.66 66.18 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.303 1.041 . . . . 0.0 112.462 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -97.03 -3.87 40.69 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 170.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.53 43.1 20.35 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.724 0.678 . . . . 0.0 112.319 -176.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -105.63 159.21 16.14 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.54 1.17 . . . . 0.0 112.836 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -108.84 131.05 10.35 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.405 1.002 . . . . 0.0 111.796 -178.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.97 130.98 44.32 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.462 0.705 . . . . 0.0 111.86 172.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.1 mt -139.6 162.21 52.46 Favored Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 123.376 0.422 . . . . 0.0 110.782 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.07 138.95 45.25 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.48 2.12 . . . . 0.0 111.509 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -53.38 -14.91 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 174.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.27 -48.68 19.32 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.735 2.014 . . . . 0.0 112.218 170.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -76.04 -33.64 59.63 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.576 1.151 . . . . 0.0 112.071 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 29.8 t -86.67 115.32 61.91 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 120.917 -1.115 . . . . 0.0 111.406 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -62.68 152.35 78.64 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.17 1.914 . . . . 0.0 110.914 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -57.64 -19.39 26.17 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.901 0.88 . . . . 0.0 113.093 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -81.5 -25.82 35.67 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.498 1.919 . . . . 0.0 114.531 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -101.38 -15.17 17.3 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.912 1.685 . . . . 0.0 112.707 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -53.72 106.29 0.18 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.958 1.303 . . . . 0.0 111.874 172.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.0 mt -89.71 165.54 14.14 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 122.252 1.025 . . . . 0.0 111.738 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 t -116.78 21.4 13.39 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.404 1.482 . . . . 0.0 111.936 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.476 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 43.1 m-85 -63.27 -18.59 63.74 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 174.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.24 66.46 2.65 Favored Glycine 0 N--CA 1.474 1.224 0 CA-C-N 120.567 1.531 . . . . 0.0 113.713 176.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.02 31.87 0.29 Allowed Glycine 0 N--CA 1.462 0.428 0 O-C-N 120.905 -1.35 . . . . 0.0 114.038 -175.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 49.0 m -137.83 164.54 28.67 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.057 0.943 . . . . 0.0 112.955 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 t -61.22 -31.28 71.06 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.1 t -139.98 -58.17 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.066 1.346 . . . . 0.0 111.716 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.5 p -147.3 155.23 11.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 122.088 0.947 . . . . 0.0 110.755 174.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 74.0 m -95.53 141.42 29.08 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 172.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -122.03 137.24 54.88 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.248 1.019 . . . . 0.0 111.787 177.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.23 103.86 4.8 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 122.082 0.944 . . . . 0.0 110.96 -178.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.5 mt -57.42 -43.34 83.74 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.967 -1.083 . . . . 0.0 111.749 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.468 0.463 0 C-N-CA 124.467 1.107 . . . . 0.0 113.743 177.766 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mttp . . . . . 0 N--CA 1.469 0.507 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.4 -36.8 64.1 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.083 0.849 . . . . 0.0 114.201 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -78.33 11.27 2.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.91 1.684 . . . . 0.0 113.448 172.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.39 18.59 63.4 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.239 1.876 . . . . 0.0 114.34 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.76 170.4 54.96 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 124.328 0.966 . . . . 0.0 112.742 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -137.96 142.61 40.5 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 122.733 1.254 . . . . 0.0 111.302 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.1 t -68.21 127.17 31.93 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.461 -0.774 . . . . 0.0 111.54 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -124.47 150.47 64.68 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 123.332 0.653 . . . . 0.0 111.887 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -71.12 157.44 57.55 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.384 2.056 . . . . 0.0 111.924 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -59.83 -27.35 66.56 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.45 -17.82 62.35 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.216 2.606 . . . . 0.0 113.08 176.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -88.14 129.17 35.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.944 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.88 121.36 21.74 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.272 0.629 . . . . 0.0 110.834 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -160.58 -176.93 5.86 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.989 1.316 . . . . 0.0 109.695 167.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.8 tppt? -92.71 126.08 37.63 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.904 1.282 . . . . 0.0 109.312 166.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.468 ' CD ' ' HE3' ' A' ' 69' ' ' LYS . 2.1 pm0 -124.9 146.98 49.07 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.325 1.45 . . . . 0.0 110.335 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -94.93 148.89 21.83 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.594 -0.691 . . . . 0.0 110.69 175.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -58.97 -42.56 90.2 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.0 0.92 . . . . 0.0 112.699 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.52 -30.09 57.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.3 1.04 . . . . 0.0 111.908 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.22 -37.44 20.09 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.053 0.941 . . . . 0.0 111.852 -178.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -58.07 -33.37 68.99 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.155 -1.591 . . . . 0.0 112.212 172.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.38 -41.69 72.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.54 0.736 . . . . 0.0 112.346 172.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.8 p -80.79 -19.65 44.3 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -63.82 -25.24 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.052 0.842 . . . . 0.0 111.619 174.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.11 163.12 16.72 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 122.419 1.011 . . . . 0.0 112.083 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.2 mttm -61.3 123.44 17.75 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.444 -1.033 . . . . 0.0 110.416 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.05 22.89 60.25 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.664 -1.076 . . . . 0.0 113.518 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -135.59 165.65 25.06 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.267 1.827 . . . . 0.0 111.452 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HE3' ' CD ' ' A' ' 56' ' ' GLU . 54.6 mtpt -138.76 115.47 10.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.426 1.89 . . . . 0.0 111.941 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.3 t -73.39 104.94 4.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.91 -0.494 . . . . 0.0 110.921 -176.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.96 158.61 16.63 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.102 0.961 . . . . 0.0 110.994 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.7 m -132.48 145.41 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.712 1.605 . . . . 0.0 110.956 177.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 66.3 m95 . . . . . 0 N--CA 1.472 0.645 0 C-N-CA 124.736 1.214 . . . . 0.0 112.827 -176.466 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.1 m -54.42 -63.92 1.0 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.016 -1.052 . . . . 0.0 111.056 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.1 p -56.3 -35.2 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.447 0.699 . . . . 0.0 112.703 177.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.4 m -60.65 -29.48 69.29 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.64 1.176 . . . . 0.0 112.002 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -97.15 -8.94 28.91 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 172.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.7 32.4 30.32 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.836 -0.98 . . . . 0.0 113.2 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -78.62 170.16 17.1 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.336 1.568 . . . . 0.0 112.549 174.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.82 116.12 3.91 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 125.321 1.439 . . . . 0.0 111.081 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.43 129.9 38.07 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.694 -0.886 . . . . 0.0 111.699 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.1 mt -143.13 159.08 57.14 Favored Pre-proline 0 C--O 1.22 -0.457 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.888 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.42 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 59.3 Cg_endo -68.55 144.97 62.73 Favored 'Trans proline' 0 C--O 1.217 -0.563 0 C-N-CA 123.407 2.738 . . . . 0.0 112.549 173.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -53.04 -18.97 2.36 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 177.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.0 t -72.55 -49.19 34.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.694 2.397 . . . . 0.0 111.77 169.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -76.79 -34.2 57.97 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.369 1.067 . . . . 0.0 110.59 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.0 t -95.21 115.34 65.33 Favored Pre-proline 0 C--O 1.242 0.686 0 O-C-N 120.608 -1.308 . . . . 0.0 111.633 -175.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -62.83 153.61 71.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.958 2.438 . . . . 0.0 110.746 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -53.44 -31.93 47.53 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.46 -18.13 61.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.834 1.254 . . . . 0.0 113.239 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.39 -23.45 15.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.32 1.448 . . . . 0.0 113.599 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -53.07 117.71 3.2 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.305 -0.872 . . . . 0.0 110.759 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.5 mt -103.35 172.2 6.95 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.375 1.084 . . . . 0.0 111.195 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -117.83 25.51 10.32 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.122 1.369 . . . . 0.0 112.336 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -70.66 -14.66 62.55 Favored 'General case' 0 C--O 1.211 -0.956 0 C-N-CA 123.528 0.731 . . . . 0.0 111.964 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.33 85.19 0.02 OUTLIER Glycine 0 N--CA 1.469 0.858 0 CA-C-O 123.243 1.468 . . . . 0.0 113.627 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.16 29.51 0.02 OUTLIER Glycine 0 C--O 1.225 -0.458 0 O-C-N 120.604 -1.527 . . . . 0.0 114.202 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.7 m -129.7 158.71 38.62 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.475 1.11 . . . . 0.0 111.169 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.6 m -47.68 -48.57 29.09 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.399 1.08 . . . . 0.0 112.785 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.42 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -128.22 -59.03 1.19 Allowed 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.518 1.527 . . . . 0.0 110.961 179.62 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.06 145.14 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 122.886 1.327 . . . . 0.0 109.676 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 t -82.59 139.16 33.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.561 171.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.73 132.88 56.41 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.955 1.702 . . . . 0.0 110.781 174.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.16 103.49 4.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 123.28 1.514 . . . . 0.0 112.319 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.6 mt -55.06 -42.25 72.49 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.697 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.529 1.532 . . . . 0.0 113.205 179.766 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.224 -0.275 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.97 -36.66 74.71 Favored Glycine 0 CA--C 1.533 1.189 0 O-C-N 123.711 0.632 . . . . 0.0 113.247 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HZ2' ' CD ' ' A' ' 60' ' ' GLU . 26.3 mtmm -86.36 16.43 4.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.465 1.906 . . . . 0.0 114.137 175.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.12 47.69 79.23 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.46 1.028 . . . . 0.0 112.993 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -101.34 164.36 18.0 Favored Glycine 0 C--O 1.244 0.728 0 C-N-CA 124.799 1.19 . . . . 0.0 113.953 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -133.3 145.97 50.93 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.905 1.682 . . . . 0.0 110.625 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.9 m -73.28 121.04 19.73 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.088 -1.008 . . . . 0.0 111.113 175.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -120.23 150.01 50.63 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.998 0.919 . . . . 0.0 111.187 177.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -68.95 154.11 71.42 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.434 2.089 . . . . 0.0 110.553 176.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.7 mt -60.29 -20.83 60.74 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -70.54 -17.27 62.93 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.372 1.869 . . . . 0.0 111.952 173.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -92.94 132.35 37.13 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 120.667 -1.27 . . . . 0.0 110.44 177.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -90.05 119.29 30.28 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.627 0.771 . . . . 0.0 110.376 174.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -167.26 166.58 14.69 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.769 1.227 . . . . 0.0 110.241 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.3 tttt -71.48 112.11 7.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.477 1.111 . . . . 0.0 108.928 175.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.433 ' HG2' ' CE ' ' A' ' 69' ' ' LYS . 1.9 pp20? -120.15 142.85 48.58 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 124.003 0.921 . . . . 0.0 109.618 175.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -98.27 141.18 31.49 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.603 0.761 . . . . 0.0 111.191 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -62.21 -39.61 93.34 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.073 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.49 -32.34 58.27 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.707 0.765 . . . . 0.0 111.772 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.537 ' CD ' ' HZ2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -77.06 -35.56 56.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 179.373 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.9 t -52.18 -34.82 46.89 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.998 1.319 . . . . 0.0 112.359 174.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.97 63.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.242 1.017 . . . . 0.0 112.734 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 40.4 t -60.08 -54.98 39.51 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.037 1.735 . . . . 0.0 111.176 175.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 87.5 m -63.19 -43.17 98.97 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 117.88 176.85 17.2 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 122.716 1.175 . . . . 0.0 113.098 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -62.42 131.75 50.26 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.793 -0.828 . . . . 0.0 111.597 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.82 -2.87 82.68 Favored Glycine 0 CA--C 1.531 1.064 0 CA-C-O 118.345 -1.253 . . . . 0.0 113.942 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.2 164.12 16.72 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.396 1.878 . . . . 0.0 109.656 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.433 ' CE ' ' HG2' ' A' ' 56' ' ' GLU . 23.7 mtpt -133.55 125.09 28.1 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.239 1.816 . . . . 0.0 109.725 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 t -78.61 100.4 6.97 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 122.855 0.462 . . . . 0.0 111.035 176.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.47 136.66 38.27 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.648 0.737 . . . . 0.0 111.043 176.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.6 m -103.66 144.46 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.154 0.982 . . . . 0.0 111.21 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.8 m95 . . . . . 0 CA--C 1.531 0.221 0 C-N-CA 123.374 0.67 . . . . 0.0 111.326 179.047 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 121.678 0.752 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.3 m -56.91 -57.55 12.02 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 121.175 -0.953 . . . . 0.0 110.638 178.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.26 -33.01 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.66 -0.65 . . . . 0.0 112.384 177.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -62.29 -31.13 71.68 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.329 0.652 . . . . 0.0 111.28 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -96.95 -10.44 26.32 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.24 45.5 4.08 Favored Glycine 0 C--O 1.222 -0.651 0 CA-C-O 118.423 -1.209 . . . . 0.0 111.324 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.506 ' CE2' ' CZ ' ' A' ' 24' ' ' TYR . 77.3 m-85 -108.27 163.25 13.35 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.121 0.96 . . . . 0.0 111.358 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 131.84 10.42 Favored Glycine 0 CA--C 1.523 0.536 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.781 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.8 m -80.43 118.99 22.54 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.048 177.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 30.6 mt -132.93 154.95 81.6 Favored Pre-proline 0 C--O 1.211 -0.944 0 O-C-N 124.171 0.92 . . . . 0.0 112.025 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.52 141.21 72.67 Favored 'Trans proline' 0 C--O 1.213 -0.769 0 C-N-CA 124.394 3.396 . . . . 0.0 110.395 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -49.79 -30.97 10.63 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.896 0.879 . . . . 0.0 112.594 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 t -65.85 -44.53 85.18 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.185 1.179 . . . . 0.0 114.185 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.5 -47.57 59.86 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.392 0.677 . . . . 0.0 112.363 174.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -86.0 128.74 56.84 Favored Pre-proline 0 CA--C 1.541 0.615 0 CA-C-O 121.422 0.629 . . . . 0.0 111.9 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -65.5 144.71 80.32 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.289 1.992 . . . . 0.0 110.958 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -51.85 -19.74 1.88 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 173.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -78.31 -36.11 46.92 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.779 0.832 . . . . 0.0 112.792 176.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.72 -28.31 26.4 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 116.026 -1.94 . . . . 0.0 110.776 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -44.14 119.82 1.92 Allowed 'General case' 0 C--N 1.345 0.396 0 O-C-N 125.105 1.503 . . . . 0.0 110.625 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 mt -103.18 178.4 4.57 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.2 p -121.35 30.26 6.86 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.157 0.983 . . . . 0.0 111.109 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.506 ' CZ ' ' CE2' ' A' ' 8' ' ' PHE . 62.7 m-85 -69.14 -19.18 64.02 Favored 'General case' 0 C--O 1.202 -1.409 0 CA-C-O 119.085 -0.483 . . . . 0.0 110.461 177.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.53 49.68 75.91 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 120.768 1.622 . . . . 0.0 111.804 178.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -143.23 36.67 1.56 Allowed Glycine 0 C--O 1.223 -0.592 0 CA-C-O 117.944 -1.476 . . . . 0.0 112.703 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 91.5 m -144.94 151.25 38.35 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 117.59 0.695 . . . . 0.0 111.4 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 p -63.22 -43.22 98.72 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 123.652 0.595 . . . . 0.0 111.558 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.1 p -105.93 -74.67 0.65 Allowed 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.001 0.52 . . . . 0.0 109.744 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.9 p -151.92 144.42 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 123.499 1.619 . . . . 0.0 111.336 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.8 t -80.34 128.24 33.33 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 120.594 -1.316 . . . . 0.0 111.059 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -106.43 138.27 42.92 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 124.049 0.843 . . . . 0.0 112.033 177.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -83.11 104.66 13.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.6 mt -65.26 -30.39 71.26 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 120.837 -1.164 . . . . 0.0 110.854 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 p . . . . . 0 N--CA 1.464 0.265 0 O-C-N 120.484 -1.385 . . . . 0.0 112.634 178.546 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp . . . . . 0 C--O 1.216 -0.664 0 CA-C-O 119.242 -0.408 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.68 -31.67 45.74 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 122.994 0.331 . . . . 0.0 112.854 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -77.05 14.53 0.85 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.69 32.87 85.64 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 123.958 0.789 . . . . 0.0 112.091 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.74 179.2 30.21 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 122.091 0.828 . . . . 0.0 113.168 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -146.8 153.67 40.46 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 123.218 1.485 . . . . 0.0 111.719 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.1 m -67.48 131.68 46.15 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.702 -1.249 . . . . 0.0 113.196 172.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -130.44 148.87 71.66 Favored Pre-proline 0 N--CA 1.452 -0.366 0 CA-C-O 121.65 0.738 . . . . 0.0 111.594 178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.86 152.28 77.45 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.584 2.189 . . . . 0.0 111.405 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.415 ' CD2' ' HG3' ' A' ' 69' ' ' LYS . 12.9 mt -63.49 -18.96 64.34 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 176.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -81.34 -12.7 58.94 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.724 0.81 . . . . 0.0 111.399 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -94.19 136.09 34.86 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 120.965 -1.085 . . . . 0.0 110.444 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -86.19 123.2 31.21 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.986 176.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -169.74 -176.86 2.5 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.48 0.712 . . . . 0.0 111.156 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -97.4 109.02 21.86 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.611 0.764 . . . . 0.0 112.837 174.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -113.05 137.51 51.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.133 0.968 . . . . 0.0 110.987 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.404 ' CD1' ' H ' ' A' ' 59' ' ' ALA . 0.3 OUTLIER -83.28 145.34 29.15 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.53 176.237 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -66.75 -42.59 85.95 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.594 0.711 . . . . 0.0 112.776 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . 0.404 ' H ' ' CD1' ' A' ' 57' ' ' LEU . . . -73.48 -32.53 64.35 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.474 -0.766 . . . . 0.0 111.869 177.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -78.22 -39.5 40.27 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.409 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.5 p -53.18 -32.62 48.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 124.721 1.209 . . . . 0.0 112.0 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.22 -30.28 64.44 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.1 p -61.36 -51.45 68.77 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 123.39 0.676 . . . . 0.0 111.665 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.4 t -66.23 -33.91 76.82 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.55 0.34 . . . . 0.0 110.117 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -178.92 27.99 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 123.291 1.495 . . . . 0.0 112.155 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -64.14 154.01 35.98 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.208 -1.172 . . . . 0.0 111.361 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.21 8.84 71.09 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.745 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -143.06 157.24 44.71 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.048 0.939 . . . . 0.0 110.604 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.415 ' HG3' ' CD2' ' A' ' 50' ' ' LEU . 5.6 mtmp? -128.53 120.65 27.17 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.384 0.674 . . . . 0.0 111.001 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.3 t -80.15 102.09 9.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.212 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.19 168.26 14.14 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 175.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.0 p -128.43 144.44 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 C-N-CA 123.763 0.825 . . . . 0.0 111.237 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 23.8 m95 . . . . . 0 CA--C 1.517 -0.297 0 CA-C-O 121.89 0.852 . . . . 0.0 111.786 175.989 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 . . . . . 0 C--O 1.212 -0.883 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -46.26 -56.04 6.32 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 121.411 -0.806 . . . . 0.0 110.99 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.9 -23.88 21.97 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.634 0 CA-C-O 121.054 0.454 . . . . 0.0 111.681 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 t -64.66 -35.13 80.04 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 121.516 0.674 . . . . 0.0 111.203 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.472 ' HD3' ' CD2' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -97.23 -13.75 21.83 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.811 -0.556 . . . . 0.0 111.602 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.2 29.84 7.33 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 119.018 -0.879 . . . . 0.0 112.621 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.417 ' CD2' ' HB2' ' A' ' 6' ' ' LYS . 57.4 m-85 -85.38 173.89 9.96 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.374 0.587 . . . . 0.0 111.389 179.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.2 131.71 7.3 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.644 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.8 m -83.73 132.18 34.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 122.608 -0.348 . . . . 0.0 111.134 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.0 mt -151.24 154.66 34.11 Favored Pre-proline 0 C--O 1.199 -1.555 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.27 137.54 40.47 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.84 3.027 . . . . 0.0 111.626 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.441 ' CG ' HG12 ' A' ' 30' ' ' VAL . 87.2 mt-30 -46.82 -31.27 2.93 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 123.111 0.564 . . . . 0.0 110.437 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.7 t -57.78 -43.95 85.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 121.782 -0.574 . . . . 0.0 112.368 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -86.4 -33.66 20.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.548 0.69 . . . . 0.0 112.117 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.5 t -90.63 125.22 60.2 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-O 121.498 0.666 . . . . 0.0 111.345 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.47 148.93 74.13 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.024 2.482 . . . . 0.0 111.712 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -14.59 6.15 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.054 0.541 . . . . 0.0 111.844 177.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -85.82 -23.71 27.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.84 0.456 . . . . 0.0 112.116 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -98.2 -25.41 14.9 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 122.74 0.416 . . . . 0.0 111.114 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.0 mtt180 -46.9 123.44 5.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.344 0.658 . . . . 0.0 110.3 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.0 mt -107.99 177.07 4.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.343 0.592 . . . . 0.0 110.406 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.8 m -133.04 36.36 3.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.816 0.817 . . . . 0.0 111.341 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.472 ' CD2' ' HD3' ' A' ' 6' ' ' LYS . 11.3 m-85 -71.54 -18.35 62.27 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 121.716 -0.615 . . . . 0.0 110.74 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.9 82.79 0.12 Allowed Glycine 0 C--O 1.22 -0.731 0 CA-C-O 122.83 1.239 . . . . 0.0 111.728 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 178.87 26.46 0.04 OUTLIER Glycine 0 C--O 1.22 -0.726 0 O-C-N 120.545 -1.562 . . . . 0.0 113.245 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 86.5 m -129.75 149.97 51.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.595 0.358 . . . . 0.0 111.477 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.4 p -63.97 -39.83 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.189 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.9 p -112.39 -75.22 0.61 Allowed 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 121.358 0.599 . . . . 0.0 110.627 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.441 HG12 ' CG ' ' A' ' 13' ' ' GLN . 7.1 p -152.99 134.11 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-O 123.387 1.565 . . . . 0.0 111.057 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 m -69.83 138.05 52.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 120.124 -1.61 . . . . 0.0 111.513 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -114.12 148.77 36.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.151 0.501 . . . . 0.0 111.084 178.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -92.25 106.33 18.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.163 0.506 . . . . 0.0 110.848 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 mt -66.87 -35.0 79.03 Favored 'General case' 0 C--O 1.219 -0.548 0 O-C-N 121.849 -0.532 . . . . 0.0 110.879 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.332 -0.18 0 C-N-CA 122.58 0.352 . . . . 0.0 111.542 178.968 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.307 0 CA-C-O 120.814 0.34 . . . . 0.0 110.79 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.82 -42.79 92.12 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -79.58 9.43 4.98 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.675 0.39 . . . . 0.0 111.658 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.17 38.85 24.91 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 112.337 -0.305 . . . . 0.0 112.337 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.94 173.37 19.09 Favored Glycine 0 N--CA 1.451 -0.35 0 O-C-N 122.591 -0.359 . . . . 0.0 112.506 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -151.71 157.32 41.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.158 0.98 . . . . 0.0 111.639 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 t -71.95 133.39 45.34 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 121.409 -0.807 . . . . 0.0 111.612 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -133.84 147.74 65.5 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 122.021 0.915 . . . . 0.0 111.65 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.28 156.19 66.6 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.943 2.429 . . . . 0.0 112.111 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.431 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 18.3 mt -60.25 -16.44 33.81 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.609 178.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -80.69 -14.38 58.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.425 0.631 . . . . 0.0 111.49 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -90.93 147.37 23.17 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 121.378 -0.826 . . . . 0.0 110.746 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -106.68 122.07 45.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.357 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -174.74 164.87 3.64 Favored 'General case' 0 C--O 1.2 -1.525 0 C-N-CA 122.739 0.415 . . . . 0.0 111.877 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm -75.25 113.4 12.57 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.637 -0.664 . . . . 0.0 110.296 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.21 132.57 46.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 122.188 0.994 . . . . 0.0 110.842 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 tp -80.96 132.29 35.39 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.084 -1.01 . . . . 0.0 110.588 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -55.88 -39.3 71.34 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 122.154 -0.341 . . . . 0.0 111.575 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.77 70.21 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.691 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -78.68 -36.72 43.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 122.411 0.285 . . . . 0.0 111.51 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 18.6 m -51.96 -37.79 54.24 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 123.411 0.684 . . . . 0.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.27 -28.36 58.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.9 m -56.93 -58.27 8.9 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.237 0.615 . . . . 0.0 110.805 179.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.3 m -60.16 -37.97 81.76 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.137 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 119.31 -156.41 15.75 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-O 122.173 0.874 . . . . 0.0 111.871 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.5 pttt -89.25 133.14 34.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 O-C-N 121.614 -0.933 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 13.74 60.38 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 121.188 -0.529 . . . . 0.0 113.032 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -144.56 150.0 36.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.865 0.466 . . . . 0.0 111.034 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.431 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 16.5 mmtp -127.95 122.03 31.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.434 0.635 . . . . 0.0 111.456 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -78.47 110.51 13.61 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.822 -0.549 . . . . 0.0 111.431 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 95.6 m -99.46 162.61 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.509 0.671 . . . . 0.0 111.509 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.1 p -119.18 144.55 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.816 -0.553 . . . . 0.0 110.971 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 29.6 m95 . . . . . 0 C--N 1.325 -0.478 0 CA-C-O 121.544 0.688 . . . . 0.0 111.056 178.577 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 110.475 -0.194 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.424 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -50.9 -48.05 60.6 Favored 'General case' 0 C--N 1.342 0.25 0 O-C-N 121.644 -0.66 . . . . 0.0 111.853 177.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.6 p -57.17 -29.96 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 t -71.17 -29.59 65.38 Favored 'General case' 0 C--O 1.23 0.043 0 C-N-CA 124.252 1.021 . . . . 0.0 111.247 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.464 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -94.02 -11.81 29.98 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 174.452 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.98 45.76 4.7 Favored Glycine 0 C--O 1.224 -0.504 0 O-C-N 124.339 1.025 . . . . 0.0 111.693 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.455 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 54.0 m-85 -111.21 163.75 13.59 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.401 1.101 . . . . 0.0 111.369 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.94 136.08 12.66 Favored Glycine 0 CA--C 1.522 0.504 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 83.3 m -80.56 125.36 29.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.621 176.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 48.7 mt -137.7 155.94 74.84 Favored Pre-proline 0 C--O 1.214 -0.799 0 O-C-N 124.01 0.819 . . . . 0.0 112.078 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.1 140.81 67.05 Favored 'Trans proline' 0 C--O 1.214 -0.697 0 C-N-CA 124.254 3.303 . . . . 0.0 110.255 178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -49.5 -31.0 9.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.959 0.903 . . . . 0.0 112.745 176.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.0 t -66.13 -44.92 82.84 Favored 'General case' 0 C--O 1.224 -0.289 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -72.41 -44.97 61.71 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.571 0.748 . . . . 0.0 112.475 175.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 13.9 t -89.51 124.68 63.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 121.444 -0.785 . . . . 0.0 112.278 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -64.01 149.27 90.87 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.694 2.263 . . . . 0.0 111.206 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -54.2 -18.15 3.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -79.34 -32.66 43.35 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.968 0.907 . . . . 0.0 113.198 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.02 -23.2 21.55 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.686 177.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -45.48 116.49 1.17 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.938 0.895 . . . . 0.0 110.701 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.1 mt -95.52 177.27 5.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 122.339 1.066 . . . . 0.0 109.267 -178.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.1 m -130.4 28.68 4.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.192 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.464 ' CE1' ' HG3' ' A' ' 6' ' ' LYS . 37.7 m-85 -70.4 -19.36 63.01 Favored 'General case' 0 C--O 1.211 -0.936 0 O-C-N 121.891 -0.505 . . . . 0.0 111.525 177.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.89 78.87 0.26 Allowed Glycine 0 CA--C 1.527 0.839 0 CA-C-O 124.19 1.995 . . . . 0.0 111.555 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.29 27.88 0.09 OUTLIER Glycine 0 C--O 1.218 -0.86 0 O-C-N 118.968 -2.489 . . . . 0.0 112.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 84.5 m -135.62 143.48 45.58 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 117.863 0.831 . . . . 0.0 111.125 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.8 m -61.6 -33.99 74.86 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.519 1.137 . . . . 0.0 111.531 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 54.3 p -113.23 -76.0 0.59 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 123.184 0.593 . . . . 0.0 111.011 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.6 p -151.69 145.19 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 123.255 1.502 . . . . 0.0 111.261 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 1.9 m -81.17 137.04 35.93 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 120.07 -1.644 . . . . 0.0 110.303 175.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.07 141.08 46.18 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.654 0.782 . . . . 0.0 112.165 176.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -83.57 104.61 13.84 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.904 0.859 . . . . 0.0 110.434 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.7 mt -66.08 -32.61 74.17 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 121.432 -0.792 . . . . 0.0 110.992 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.1 m . . . . . 0 C--N 1.322 -0.594 0 O-C-N 119.544 -1.973 . . . . 0.0 112.45 177.289 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.511 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -62.48 -37.88 95.41 Favored Glycine 0 C--O 1.219 -0.808 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -177.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -78.87 15.93 0.99 Allowed 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.971 0.908 . . . . 0.0 112.508 174.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 65.89 30.54 77.33 Favored Glycine 0 CA--C 1.529 0.932 0 O-C-N 121.386 -0.821 . . . . 0.0 112.078 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.62 166.4 54.14 Favored Glycine 0 CA--C 1.524 0.653 0 O-C-N 122.033 -0.687 . . . . 0.0 112.388 177.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -144.44 154.73 43.25 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.656 1.217 . . . . 0.0 111.206 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.4 109.09 4.01 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.573 -0.704 . . . . 0.0 112.491 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -106.81 148.7 37.38 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 121.805 0.812 . . . . 0.0 111.993 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -67.14 153.54 77.21 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.55 2.167 . . . . 0.0 110.99 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 mt -60.21 -16.45 33.5 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 174.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -78.25 -18.21 55.65 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.098 0.959 . . . . 0.0 112.258 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -87.38 145.65 26.22 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.455 -1.403 . . . . 0.0 110.822 176.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -98.95 121.96 41.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.886 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -174.17 161.27 3.52 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 123.832 0.853 . . . . 0.0 111.202 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.19 110.52 6.7 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 122.702 0.401 . . . . 0.0 110.748 177.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.421 ' OE1' ' HB3' ' A' ' 61' ' ' SER . 0.8 OUTLIER -125.11 133.57 52.81 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.619 1.199 . . . . 0.0 110.112 178.191 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.1 tp -82.48 129.21 34.86 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 171.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -51.67 -40.01 59.28 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.441 -0.787 . . . . 0.0 113.002 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.45 -24.75 67.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.273 1.029 . . . . 0.0 111.998 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -91.17 -42.5 10.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.662 1.185 . . . . 0.0 113.489 176.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.421 ' HB3' ' OE1' ' A' ' 56' ' ' GLU . 24.8 p -52.24 -26.68 12.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.739 0.699 . . . . 0.0 112.82 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.27 85.16 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 175.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.5 t -67.33 -50.26 60.77 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.186 0.994 . . . . 0.0 111.635 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 10.8 m -51.71 -38.32 54.65 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.667 0.387 . . . . 0.0 112.043 178.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 121.08 156.36 9.78 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.808 1.227 . . . . 0.0 111.036 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -51.68 129.97 27.3 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.168 -1.195 . . . . 0.0 110.992 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.71 12.14 64.79 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -135.63 157.21 47.43 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 124.101 0.961 . . . . 0.0 110.445 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -135.17 120.58 19.14 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 124.834 1.253 . . . . 0.0 110.34 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.78 98.84 0.56 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.447 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 65.8 m -97.31 159.85 14.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.738 1.256 . . . . 0.0 111.351 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -111.97 145.29 18.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 O-C-N 121.522 -0.736 . . . . 0.0 110.92 177.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.9 m95 . . . . . 0 CA--C 1.51 -0.571 0 CA-C-O 117.609 -1.186 . . . . 0.0 113.889 178.97 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 . . . . . 0 N--CA 1.472 0.639 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.496 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 68.3 m -51.32 -60.16 3.43 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.732 1.213 . . . . 0.0 110.102 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -57.54 -33.71 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 175.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t -64.79 -26.87 68.53 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.983 1.313 . . . . 0.0 111.793 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 -10.65 23.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.505 174.078 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.15 30.83 21.64 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 124.32 0.962 . . . . 0.0 113.666 -177.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -82.39 165.32 20.39 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.249 1.024 . . . . 0.0 112.776 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.2 123.2 6.59 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.609 1.1 . . . . 0.0 111.721 178.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -72.85 131.53 42.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.636 -0.92 . . . . 0.0 111.878 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.5 mt -140.99 161.84 51.54 Favored Pre-proline 0 CA--C 1.535 0.369 0 O-C-N 124.007 0.817 . . . . 0.0 111.107 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.98 142.27 50.9 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.364 2.043 . . . . 0.0 111.067 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.45 -20.39 7.47 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -70.24 -46.81 63.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.049 1.34 . . . . 0.0 112.525 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.29 -39.08 49.25 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.334 1.053 . . . . 0.0 111.076 176.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.8 t -86.68 110.92 36.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 O-C-N 120.481 -1.387 . . . . 0.0 112.024 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -61.24 150.29 85.34 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.911 2.407 . . . . 0.0 110.434 -178.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -49.97 -23.68 2.15 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 176.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -72.46 -42.49 64.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.465 1.906 . . . . 0.0 111.818 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.26 -20.6 31.92 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.337 -1.316 . . . . 0.0 113.049 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -52.14 106.39 0.15 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.282 1.401 . . . . 0.0 111.802 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.0 mt -90.19 172.7 8.61 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.826 0.822 . . . . 0.0 111.259 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 m -123.72 27.36 7.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 112.786 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.496 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 11.8 m-85 -71.75 -15.81 62.19 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.371 0.668 . . . . 0.0 111.489 178.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.99 80.43 0.09 OUTLIER Glycine 0 N--CA 1.468 0.818 0 CA-C-O 123.63 1.684 . . . . 0.0 112.432 175.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -178.39 28.27 0.06 OUTLIER Glycine 0 C--O 1.223 -0.587 0 O-C-N 120.509 -1.583 . . . . 0.0 114.904 -176.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 52.0 m -133.7 159.71 39.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 123.54 0.736 . . . . 0.0 110.981 175.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.2 m -52.39 -48.59 65.54 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 124.175 0.99 . . . . 0.0 112.927 -179.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.58 -61.52 1.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.34 1.456 . . . . 0.0 110.557 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.3 p -144.35 153.27 15.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.682 0.753 . . . . 0.0 111.294 176.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 82.9 m -90.77 136.5 33.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.741 0.816 . . . . 0.0 109.109 171.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -114.29 137.37 51.88 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.995 1.318 . . . . 0.0 111.821 174.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -81.71 101.52 10.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.027 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 mt -62.75 -35.53 80.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.954 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.472 0.629 0 C-N-CA 125.524 1.53 . . . . 0.0 111.522 176.909 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.1 mmtp . . . . . 0 C--O 1.222 -0.354 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.32 -38.37 61.96 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 123.44 0.543 . . . . 0.0 113.372 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.3 mttm -80.15 11.84 3.22 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.943 1.697 . . . . 0.0 114.061 174.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.36 30.78 72.09 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.594 1.092 . . . . 0.0 113.276 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.64 163.7 40.7 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 123.507 0.575 . . . . 0.0 112.69 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -125.87 144.7 50.56 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.469 1.507 . . . . 0.0 111.115 -178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.25 128.88 38.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 121.132 -0.98 . . . . 0.0 110.332 176.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -130.74 146.8 63.53 Favored Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 121.45 -0.781 . . . . 0.0 111.654 177.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -66.06 157.86 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.368 2.045 . . . . 0.0 110.428 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.3 mt -62.08 -22.2 65.58 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -77.86 -13.43 59.89 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.646 1.578 . . . . 0.0 113.078 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -87.49 135.46 33.34 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 120.429 -1.419 . . . . 0.0 110.0 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -99.94 123.51 44.26 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.238 1.415 . . . . 0.0 110.371 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -165.65 178.55 6.58 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 125.275 1.43 . . . . 0.0 109.805 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -80.42 110.42 15.85 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 121.446 -0.784 . . . . 0.0 110.302 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -121.9 133.31 54.86 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.452 1.101 . . . . 0.0 111.35 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 13.3 tp -88.44 133.63 34.07 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.914 -1.116 . . . . 0.0 109.344 173.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -50.3 -40.38 48.41 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.029 1.732 . . . . 0.0 113.813 172.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.6 -25.75 66.77 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.791 1.236 . . . . 0.0 112.381 176.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -94.13 -28.49 15.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.233 1.013 . . . . 0.0 112.718 174.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.0 t -51.66 -38.5 55.19 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 125.658 1.583 . . . . 0.0 111.638 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.14 -44.13 67.52 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.289 1.436 . . . . 0.0 113.474 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 t -44.58 -55.96 4.73 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.138 1.775 . . . . 0.0 112.753 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 18.0 m -77.12 -58.48 3.26 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.485 172.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 36.87 -146.07 0.08 OUTLIER Glycine 0 N--CA 1.472 1.057 0 C-N-CA 128.504 2.954 . . . . 0.0 112.255 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 pttt 42.05 42.83 2.53 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 121.142 2.471 . . . . 0.0 117.174 172.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 86.26 17.05 61.47 Favored Glycine 0 CA--C 1.542 1.726 0 N-CA-C 115.36 0.904 . . . . 0.0 115.36 -174.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -142.16 152.55 43.3 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.042 2.537 . . . . 0.0 109.957 -177.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -129.09 160.84 31.54 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.842 -1.161 . . . . 0.0 109.986 176.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 47.6 t -97.91 107.41 19.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.394 0.678 . . . . 0.0 110.779 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.41 152.1 23.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.167 0.508 . . . . 0.0 110.978 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -117.93 146.8 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.093 0.957 . . . . 0.0 110.986 176.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.7 m95 . . . . . 0 N--CA 1.466 0.329 0 C-N-CA 124.112 0.965 . . . . 0.0 111.771 178.443 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 N--CA 1.469 0.515 0 N-CA-C 111.337 0.125 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -50.16 -48.22 54.02 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.409 0.683 . . . . 0.0 111.823 176.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.29 -33.91 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 124.78 1.232 . . . . 0.0 113.21 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -68.39 -28.18 66.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.138 1.375 . . . . 0.0 112.066 177.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -96.57 -5.69 38.62 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.04 40.84 28.92 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.862 0.755 . . . . 0.0 113.533 -176.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.51 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 57.0 m-85 -94.9 167.21 11.56 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.334 1.054 . . . . 0.0 112.918 172.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.51 127.5 7.89 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.437 1.018 . . . . 0.0 111.627 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.6 m -72.41 134.29 45.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.782 -0.834 . . . . 0.0 111.865 171.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 33.0 mt -142.73 163.47 38.38 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.257 175.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.55 137.51 39.43 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.116 2.544 . . . . 0.0 112.203 172.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -52.75 -17.1 1.17 Allowed 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -46.44 56.49 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.342 1.857 . . . . 0.0 112.041 171.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.05 -35.98 28.18 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.581 1.152 . . . . 0.0 112.107 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.5 t -87.26 109.47 25.77 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.757 -1.215 . . . . 0.0 112.08 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.06 150.66 87.64 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.933 2.422 . . . . 0.0 111.509 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -55.05 -18.38 5.22 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -78.74 -33.16 46.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.525 1.53 . . . . 0.0 112.931 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.81 -17.15 23.41 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.52 1.528 . . . . 0.0 112.666 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -51.75 109.48 0.36 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.09 0.956 . . . . 0.0 111.873 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 36.9 mt -86.03 170.54 12.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.915 0.864 . . . . 0.0 111.882 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.3 t -120.13 22.05 11.56 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.961 1.305 . . . . 0.0 112.224 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.51 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 60.4 m-85 -70.29 -19.68 63.08 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 175.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.26 73.04 0.5 Allowed Glycine 0 N--CA 1.471 0.985 0 O-C-N 120.608 -1.308 . . . . 0.0 113.684 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -167.02 30.19 0.19 Allowed Glycine 0 N--CA 1.464 0.507 0 O-C-N 120.407 -1.643 . . . . 0.0 114.163 -176.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 59.9 m -130.55 163.22 27.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.195 0.998 . . . . 0.0 112.109 178.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.0 m -59.08 -31.43 68.88 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.837 1.255 . . . . 0.0 113.198 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 t -144.75 -55.22 0.33 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.605 1.162 . . . . 0.0 111.933 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.3 p -146.27 151.24 14.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-O 122.357 1.075 . . . . 0.0 110.945 174.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 14.2 m -87.83 139.11 30.85 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.233 1.013 . . . . 0.0 108.646 170.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.4 136.52 53.12 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.669 0.788 . . . . 0.0 112.042 174.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -78.49 102.77 8.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.849 0.833 . . . . 0.0 111.672 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.9 mt -58.34 -38.2 76.68 Favored 'General case' 0 C--O 1.221 -0.44 0 O-C-N 121.686 -0.634 . . . . 0.0 111.642 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.469 0.488 0 C-N-CA 124.343 1.057 . . . . 0.0 111.819 178.606 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -78.83 -27.05 57.43 Favored Glycine 0 CA--C 1.535 1.302 0 O-C-N 121.309 -0.87 . . . . 0.0 114.91 -173.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.78 9.08 12.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.187 2.595 . . . . 0.0 112.713 173.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 83.58 31.21 27.86 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.617 1.58 . . . . 0.0 114.206 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -113.79 179.91 18.93 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.332 1.066 . . . . 0.0 113.112 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -150.52 157.13 42.66 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.807 0.843 . . . . 0.0 111.152 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.0 t -63.5 126.86 28.88 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.046 -1.034 . . . . 0.0 110.807 174.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -124.92 152.89 70.75 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.17 0.988 . . . . 0.0 111.357 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.18 156.76 46.68 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.356 2.037 . . . . 0.0 111.524 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.0 mt -62.52 -24.42 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 178.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -71.8 -19.52 61.99 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.891 1.276 . . . . 0.0 113.747 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -79.24 127.47 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.981 -1.074 . . . . 0.0 110.522 173.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -91.13 117.62 29.76 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.715 0.806 . . . . 0.0 111.498 172.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.66 174.39 10.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.988 176.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 tptt -72.93 124.68 25.92 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.44 -0.788 . . . . 0.0 109.236 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -123.79 142.16 51.36 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 124.808 1.243 . . . . 0.0 110.214 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.75 152.36 19.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.852 0.834 . . . . 0.0 110.355 174.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 mp0 -73.24 -38.6 65.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.389 -0.819 . . . . 0.0 110.648 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.18 58.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.317 0.647 . . . . 0.0 112.638 177.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -82.48 -43.16 17.55 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.909 0.884 . . . . 0.0 111.111 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.2 p -58.25 -31.88 67.82 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.959 -1.713 . . . . 0.0 112.096 178.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.75 -38.24 64.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.975 1.31 . . . . 0.0 113.341 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -57.96 -49.14 77.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.72 1.608 . . . . 0.0 114.107 -176.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 m -75.73 -59.16 2.87 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 169.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 38.8 -143.6 0.3 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 126.077 1.799 . . . . 0.0 112.017 -175.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? 48.23 35.56 5.63 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.02 1.859 . . . . 0.0 116.02 171.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.26 21.19 42.4 Favored Glycine 0 CA--C 1.538 1.486 0 N-CA-C 115.174 0.83 . . . . 0.0 115.174 -172.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -136.78 157.0 47.77 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.342 2.257 . . . . 0.0 111.373 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -134.49 142.17 46.97 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.399 1.88 . . . . 0.0 109.724 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.4 m -86.8 115.45 24.23 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 120.823 -1.173 . . . . 0.0 110.015 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 18.3 m -110.41 152.1 26.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.449 0.642 . . . . 0.0 112.155 176.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.2 p -123.66 143.9 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.601 0.761 . . . . 0.0 110.475 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.5 m95 . . . . . 0 CA--C 1.541 0.633 0 C-N-CA 124.465 1.106 . . . . 0.0 110.939 175.015 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.505 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 86.0 m -51.96 -46.71 64.88 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.514 1.126 . . . . 0.0 111.4 176.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.81 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.799 1.24 . . . . 0.0 112.023 176.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.2 t -67.63 -23.89 65.4 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.242 1.017 . . . . 0.0 112.093 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.424 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.3 OUTLIER -99.32 -2.12 37.19 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 171.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.18 31.92 58.93 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 118.578 -1.124 . . . . 0.0 113.179 -178.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.424 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 45.4 m-85 -88.01 166.74 14.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.275 1.43 . . . . 0.0 112.636 174.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.11 129.25 8.01 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 125.021 1.296 . . . . 0.0 110.835 -178.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.4 m -69.16 124.8 24.77 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.066 0.546 . . . . 0.0 111.578 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 mt -131.57 162.73 54.39 Favored Pre-proline 0 CA--C 1.538 0.507 0 O-C-N 124.084 0.865 . . . . 0.0 110.861 174.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.47 138.51 35.73 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 123.003 2.468 . . . . 0.0 110.576 172.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -52.51 -18.38 1.67 Allowed 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.1 t -74.5 -45.33 46.61 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.63 1.972 . . . . 0.0 112.533 171.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -74.99 -43.16 55.51 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.357 1.063 . . . . 0.0 110.971 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.7 t -84.82 119.23 72.48 Favored Pre-proline 0 C--O 1.242 0.698 0 C-N-CA 123.348 0.659 . . . . 0.0 111.906 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.4 148.23 92.86 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.471 2.114 . . . . 0.0 110.869 -178.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -49.98 -28.08 6.33 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 173.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.02 -32.84 67.54 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 174.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.38 -17.87 26.49 Favored 'General case' 0 N--CA 1.46 0.064 0 C-N-CA 125.349 1.46 . . . . 0.0 113.539 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 90.4 mtt180 -51.72 105.91 0.13 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.479 -0.763 . . . . 0.0 111.443 173.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 47.3 mt -84.64 167.33 16.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.487 1.137 . . . . 0.0 111.194 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 p -116.59 18.18 15.09 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.822 1.649 . . . . 0.0 112.426 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.505 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 51.2 m-85 -66.93 -9.21 35.81 Favored 'General case' 0 C--O 1.211 -0.921 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.17 57.37 19.5 Favored Glycine 0 N--CA 1.472 1.095 0 O-C-N 120.444 -1.41 . . . . 0.0 113.098 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -147.22 23.55 1.57 Allowed Glycine 0 C--O 1.226 -0.404 0 CA-C-O 118.767 -1.018 . . . . 0.0 115.575 -172.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 58.8 m -141.39 143.6 34.04 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.216 1.006 . . . . 0.0 111.134 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.3 m -50.24 -43.87 53.17 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.837 1.255 . . . . 0.0 113.37 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.52 -73.49 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.508 1.923 . . . . 0.0 110.509 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -148.09 153.8 11.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 123.839 0.856 . . . . 0.0 111.015 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 88.1 m -91.53 133.94 35.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.64 138.62 45.73 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.762 1.225 . . . . 0.0 112.038 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.4 95.95 7.2 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 122.912 1.339 . . . . 0.0 114.415 178.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.15 -37.31 86.7 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 120.718 -1.239 . . . . 0.0 110.927 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.47 0.544 0 O-C-N 120.008 -1.683 . . . . 0.0 113.263 179.572 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.584 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.95 -37.43 60.57 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.567 1.08 . . . . 0.0 112.226 -178.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -80.28 8.09 8.17 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.099 1.36 . . . . 0.0 113.809 174.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.68 19.27 52.44 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.195 1.379 . . . . 0.0 114.069 -177.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.39 150.26 26.97 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 125.138 1.351 . . . . 0.0 112.77 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -140.55 145.65 37.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 124.657 1.183 . . . . 0.0 110.322 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 91.4 m -71.77 114.3 9.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.522 0.729 . . . . 0.0 111.912 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -117.33 148.72 43.24 Favored Pre-proline 0 C--O 1.241 0.618 0 C-N-CA 124.172 0.989 . . . . 0.0 110.581 -179.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.79 152.7 77.22 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 121.86 1.706 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.3 mt -60.61 -18.4 52.87 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.56 -24.27 56.66 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.049 1.739 . . . . 0.0 112.844 171.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -78.26 143.29 37.18 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 119.961 -1.712 . . . . 0.0 110.582 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -102.75 120.72 41.09 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 124.535 1.134 . . . . 0.0 111.371 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.6 p -169.5 173.23 6.57 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.236 1.414 . . . . 0.0 110.943 175.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -76.0 102.26 5.57 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.89 1.276 . . . . 0.0 110.955 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -118.73 139.64 51.23 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.49 1.116 . . . . 0.0 110.342 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 17.8 mt -87.92 126.31 34.98 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 123.106 0.563 . . . . 0.0 110.171 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -60.62 -39.35 87.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.335 0.654 . . . . 0.0 111.816 -178.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.34 -26.57 58.69 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.117 0.967 . . . . 0.0 113.023 175.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -88.67 -22.33 23.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.225 1.01 . . . . 0.0 112.327 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.8 p -54.91 -29.3 55.72 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.968 1.707 . . . . 0.0 112.708 175.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.64 49.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.328 1.451 . . . . 0.0 113.053 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.1 m -55.23 -42.77 73.85 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 174.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 73.8 m -80.37 -36.62 33.72 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.821 0.448 . . . . 0.0 111.678 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 110.36 170.39 19.75 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 122.954 1.308 . . . . 0.0 112.514 179.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -56.26 134.87 53.59 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.749 -1.442 . . . . 0.0 111.092 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.13 5.4 65.85 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.977 -0.902 . . . . 0.0 114.054 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -140.99 163.63 32.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.843 2.057 . . . . 0.0 110.225 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -123.9 162.05 24.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.76 1.624 . . . . 0.0 110.151 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -123.7 97.48 5.4 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.566 0.747 . . . . 0.0 110.95 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 93.8 m -97.72 138.67 34.76 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.338 1.055 . . . . 0.0 110.157 -178.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -105.17 145.76 13.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 124.136 0.974 . . . . 0.0 111.369 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.7 m95 . . . . . 0 C--N 1.327 -0.379 0 CA-C-O 122.139 0.971 . . . . 0.0 110.839 177.621 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -110.13 -33.03 6.79 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.004 0.43 . . . . 0.0 110.575 -175.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -49.6 -58.28 5.55 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.985 0.914 . . . . 0.0 111.477 177.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.63 -31.22 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.322 0.649 . . . . 0.0 112.438 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.67 -29.45 69.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.636 1.174 . . . . 0.0 111.318 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.1 mmmp? -96.7 -9.53 28.87 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 117.286 -1.34 . . . . 0.0 114.169 174.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 84.25 34.42 17.38 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 125.107 1.504 . . . . 0.0 112.541 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.524 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 59.1 m-85 -87.58 170.53 11.23 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.985 1.314 . . . . 0.0 112.574 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.72 123.9 5.85 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.794 -0.923 . . . . 0.0 110.794 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -74.26 131.59 41.33 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 118.799 -0.62 . . . . 0.0 111.252 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 mt -144.72 160.67 46.54 Favored Pre-proline 0 CA--C 1.53 0.199 0 O-C-N 124.075 0.859 . . . . 0.0 111.071 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.446 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 55.4 Cg_endo -67.07 137.73 45.25 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.484 2.789 . . . . 0.0 110.913 174.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -52.08 -23.17 4.9 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 175.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 t -70.38 -46.44 64.06 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 124.257 1.023 . . . . 0.0 113.208 171.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -72.85 -41.17 65.06 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.957 0.903 . . . . 0.0 110.197 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.1 t -85.38 124.44 71.69 Favored Pre-proline 0 CA--C 1.541 0.622 0 O-C-N 120.591 -1.318 . . . . 0.0 111.715 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -62.71 145.73 95.05 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.696 2.264 . . . . 0.0 110.494 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -52.87 -21.33 4.14 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.72 -34.08 40.35 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.671 1.588 . . . . 0.0 112.62 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.61 -25.14 28.79 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 117.881 -1.056 . . . . 0.0 112.481 177.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -49.18 111.35 0.47 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.176 0.898 . . . . 0.0 110.933 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.7 mt -93.8 174.71 7.04 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.725 0.774 . . . . 0.0 109.879 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 m -115.14 25.24 11.03 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.009 1.324 . . . . 0.0 111.86 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.524 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 52.0 m-85 -67.93 -11.72 59.3 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.865 175.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 45.0 80.42 0.05 OUTLIER Glycine 0 N--CA 1.473 1.166 0 CA-C-N 120.882 1.673 . . . . 0.0 114.404 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 177.64 27.73 0.04 OUTLIER Glycine 0 C--O 1.226 -0.355 0 O-C-N 120.643 -1.504 . . . . 0.0 113.401 -174.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.7 m -125.89 159.26 33.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.762 0.825 . . . . 0.0 110.872 176.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.4 p -43.18 -43.58 4.73 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.463 1.105 . . . . 0.0 112.899 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.446 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 1.3 t -137.81 -61.82 0.61 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.963 1.705 . . . . 0.0 111.311 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.8 p -138.57 151.62 24.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 122.132 0.968 . . . . 0.0 110.387 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -90.76 134.1 34.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.26 173.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.81 141.26 41.09 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.113 0.965 . . . . 0.0 111.826 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -81.32 103.19 10.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.46 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.4 mt -63.61 -32.71 74.26 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 121.063 -1.023 . . . . 0.0 110.825 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.5 t -64.93 -29.61 70.56 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 119.352 -2.093 . . . . 0.0 112.709 176.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -86.67 -36.1 18.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.538 0.735 . . . . 0.0 112.924 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -88.42 -65.34 1.03 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 124.109 0.964 . . . . 0.0 110.14 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.6 t -173.06 139.52 0.83 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.8 1.24 . . . . 0.0 112.432 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -114.05 29.5 7.68 Favored Glycine 0 C--O 1.229 -0.193 0 CA-C-O 117.274 -1.848 . . . . 0.0 112.181 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.5 t -50.95 -38.4 50.28 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 119.028 1.414 . . . . 0.0 110.633 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -72.18 -49.29 36.75 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.033 0.933 . . . . 0.0 112.831 178.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.71 -34.98 79.44 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-O 119.695 -0.503 . . . . 0.0 113.354 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -80.07 14.82 1.7 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.627 1.171 . . . . 0.0 113.781 173.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.05 45.15 52.36 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 123.791 0.71 . . . . 0.0 113.265 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -124.43 159.66 19.05 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.594 1.568 . . . . 0.0 112.764 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -147.51 153.55 39.65 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.676 1.227 . . . . 0.0 111.477 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.2 m -64.34 124.31 21.41 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.927 -1.108 . . . . 0.0 112.507 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -122.64 147.97 51.96 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-O 122.019 0.914 . . . . 0.0 111.258 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.23 153.24 71.68 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.212 1.941 . . . . 0.0 110.416 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.5 mt -60.08 -22.06 62.25 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 175.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.66 -18.59 60.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.015 1.326 . . . . 0.0 112.591 175.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.9 tpp85 -87.27 127.66 35.17 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.454 176.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.03 119.38 19.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.742 175.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.2 t -165.69 176.05 8.34 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.214 1.006 . . . . 0.0 110.401 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -96.91 110.45 22.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.779 1.231 . . . . 0.0 110.466 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -111.01 138.12 47.81 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.455 1.102 . . . . 0.0 110.727 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 13.2 mt -89.16 153.2 21.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.455 -0.778 . . . . 0.0 110.433 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -63.92 -36.28 83.41 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.416 -0.802 . . . . 0.0 112.102 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.1 50.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.486 0.714 . . . . 0.0 112.285 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -81.24 -33.61 32.7 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.2 m -56.27 -31.46 63.62 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.051 -1.031 . . . . 0.0 112.16 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -40.08 70.11 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.338 1.055 . . . . 0.0 112.746 175.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -48.0 -58.64 4.17 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.423 1.489 . . . . 0.0 111.938 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.7 m -64.36 -49.64 70.86 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.593 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.13 -169.68 12.97 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-O 123.097 1.387 . . . . 0.0 112.759 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -64.94 136.74 57.18 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.713 -1.463 . . . . 0.0 111.73 177.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.05 5.33 89.33 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 119.328 -0.707 . . . . 0.0 113.56 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -136.89 161.14 36.82 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.734 1.214 . . . . 0.0 110.951 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 43.9 mttt -138.47 121.4 16.61 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.759 1.224 . . . . 0.0 110.659 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.6 t -73.8 106.92 5.74 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.7 -0.625 . . . . 0.0 111.048 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.457 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.9 OUTLIER -91.21 151.84 20.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.402 0.62 . . . . 0.0 110.662 177.153 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.75 145.48 34.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 124.209 1.003 . . . . 0.0 110.601 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.457 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 47.2 m95 -113.72 179.91 3.82 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 121.569 0.699 . . . . 0.0 111.51 175.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -76.39 34.69 0.14 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 174.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 116.578 -1.677 . . . . 0.0 111.809 -179.722 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 118.973 -0.537 . . . . 0.0 109.687 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.72 -30.74 8.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.732 -171.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.481 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 63.3 m -51.5 -56.61 12.44 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.743 1.217 . . . . 0.0 110.201 176.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.18 -32.06 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.532 1.133 . . . . 0.0 113.827 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.5 t -61.23 -33.73 73.97 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.063 1.345 . . . . 0.0 111.37 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -96.03 -5.82 40.17 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 82.61 30.06 34.0 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-O 117.695 -1.614 . . . . 0.0 113.347 -177.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -75.11 168.66 19.56 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.458 1.629 . . . . 0.0 112.936 174.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.81 114.63 3.17 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.293 1.425 . . . . 0.0 111.435 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.5 m -66.04 131.45 46.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.748 172.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.8 mt -145.11 155.63 54.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 124.04 0.838 . . . . 0.0 111.496 176.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.402 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 58.2 Cg_endo -63.43 138.27 64.66 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.509 2.139 . . . . 0.0 110.587 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -25.55 1.99 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 p -71.09 -41.17 70.98 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.998 0.919 . . . . 0.0 112.921 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -78.91 -46.22 18.92 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.822 1.649 . . . . 0.0 111.567 176.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.3 t -88.08 121.67 70.41 Favored Pre-proline 0 C--O 1.244 0.799 0 C-N-CA 124.142 0.977 . . . . 0.0 111.485 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -61.47 144.5 98.06 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.74 2.293 . . . . 0.0 110.5 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.2 pp0? -47.38 -30.12 3.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.214 1.006 . . . . 0.0 113.688 175.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -69.7 -32.97 71.87 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.962 1.305 . . . . 0.0 113.739 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.67 -20.42 21.62 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.749 1.22 . . . . 0.0 112.506 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 73.5 mtt180 -51.1 100.34 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 112.272 173.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 41.9 mt -84.28 166.41 17.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.967 0.889 . . . . 0.0 111.214 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -113.79 29.3 8.1 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.184 1.794 . . . . 0.0 112.277 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.481 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 15.2 m-85 -68.17 -17.95 64.48 Favored 'General case' 0 C--O 1.211 -0.944 0 O-C-N 121.255 -0.903 . . . . 0.0 112.57 175.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.1 74.38 0.41 Allowed Glycine 0 N--CA 1.473 1.11 0 CA-C-O 123.767 1.759 . . . . 0.0 113.29 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.73 36.54 0.07 OUTLIER Glycine 0 C--O 1.224 -0.47 0 O-C-N 120.691 -1.476 . . . . 0.0 112.299 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 53.3 m -134.75 160.95 36.57 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 117.012 0.406 . . . . 0.0 111.545 170.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.8 m -54.68 -37.61 65.98 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.121 0.969 . . . . 0.0 112.966 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.402 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -135.44 -56.34 0.79 Allowed 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.279 1.432 . . . . 0.0 110.382 -179.474 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.4 p -152.76 145.49 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.992 0.917 . . . . 0.0 111.898 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 61.2 m -86.2 134.33 33.79 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.091 172.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.62 146.59 29.48 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.108 0.963 . . . . 0.0 110.962 172.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -86.21 107.35 17.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.723 0.809 . . . . 0.0 112.05 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.34 -29.56 70.54 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.469 -0.77 . . . . 0.0 111.704 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.4 m -72.29 -18.31 61.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 119.818 -1.801 . . . . 0.0 113.087 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.9 mmtt -96.46 -38.06 10.17 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.637 1.175 . . . . 0.0 111.878 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.82 -68.87 0.73 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.351 1.06 . . . . 0.0 110.33 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.9 t -166.6 136.63 3.17 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 123.599 1.666 . . . . 0.0 112.769 -174.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -102.45 24.52 30.69 Favored Glycine 0 C--O 1.222 -0.605 0 CA-C-O 116.177 -2.457 . . . . 0.0 113.965 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.4 t -46.85 -62.99 1.14 Allowed 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 121.27 2.535 . . . . 0.0 111.006 -172.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -33.37 52.76 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 174.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.18 65.92 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-N 118.261 0.482 . . . . 0.0 113.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -88.75 12.27 15.41 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.015 1.726 . . . . 0.0 113.52 173.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.47 40.47 9.92 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.691 1.139 . . . . 0.0 112.411 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.14 165.02 31.33 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 121.566 0.537 . . . . 0.0 113.578 174.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -146.93 154.61 41.48 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.912 1.285 . . . . 0.0 112.081 -176.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.0 t -73.28 127.14 31.79 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.716 -1.24 . . . . 0.0 110.604 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -126.33 149.93 68.66 Favored Pre-proline 0 CA--C 1.543 0.695 0 C-N-CA 123.607 0.763 . . . . 0.0 111.074 -178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.28 158.91 55.51 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.524 2.15 . . . . 0.0 111.744 176.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.0 mt -61.71 -19.79 62.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.525 0.73 . . . . 0.0 112.935 176.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -80.99 -15.41 56.29 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.004 2.122 . . . . 0.0 112.618 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -87.12 137.33 32.44 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 120.962 -1.087 . . . . 0.0 109.718 174.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.6 120.41 28.89 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.793 1.237 . . . . 0.0 111.075 172.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.13 -177.91 5.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.003 0.921 . . . . 0.0 110.361 174.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.62 112.51 22.39 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.357 -0.839 . . . . 0.0 110.404 170.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.28 133.03 50.21 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.308 1.443 . . . . 0.0 113.02 177.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mt -87.52 154.77 20.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 120.435 -1.416 . . . . 0.0 110.265 177.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -68.3 -36.79 79.87 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.92 -37.56 67.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.062 0.545 . . . . 0.0 110.993 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -75.99 -30.5 58.58 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.1 t -49.08 -44.77 42.29 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.273 0.629 . . . . 0.0 112.179 171.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.62 -38.75 72.51 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.511 -0.757 . . . . 0.0 112.978 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.6 t -51.11 -44.75 61.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.527 1.531 . . . . 0.0 112.725 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.8 m -68.4 -60.29 2.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.409 0.684 . . . . 0.0 112.152 172.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 136.55 -156.73 23.26 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 122.387 0.993 . . . . 0.0 113.816 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -80.88 133.14 35.52 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.762 -1.434 . . . . 0.0 111.574 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.24 10.0 84.29 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 123.916 0.77 . . . . 0.0 114.381 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -137.56 155.14 49.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.013 1.325 . . . . 0.0 109.948 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -136.26 131.04 33.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.503 1.921 . . . . 0.0 109.437 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.4 t -73.56 111.04 8.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.404 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 40.5 m -106.21 161.29 14.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.557 0.694 . . . . 0.0 111.724 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p -129.59 144.16 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 123.556 0.743 . . . . 0.0 111.121 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -101.53 -178.73 3.81 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 122.484 1.135 . . . . 0.0 111.008 174.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.7 mp -57.69 110.83 0.96 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.094 0.957 . . . . 0.0 108.955 168.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.264 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 171.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.483 1.188 0 CA-C-O 119.035 -0.507 . . . . 0.0 109.886 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -121.69 -41.3 2.48 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.809 0.338 . . . . 0.0 111.34 -172.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.555 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 87.4 m -50.83 -51.26 52.85 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.093 -1.004 . . . . 0.0 111.109 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -59.33 -32.35 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.202 1.001 . . . . 0.0 113.302 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.4 t -67.04 -29.07 68.77 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.66 1.584 . . . . 0.0 111.309 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.405 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 35.1 mmtt -94.31 -5.59 46.32 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 172.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.08 37.22 25.74 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-O 118.293 -1.282 . . . . 0.0 112.947 -177.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.438 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 43.1 m-85 -98.87 161.53 13.58 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.636 1.975 . . . . 0.0 112.216 174.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.72 130.49 9.12 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.303 0.954 . . . . 0.0 111.528 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.3 134.2 48.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 118.105 -0.95 . . . . 0.0 111.939 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.2 mt -145.39 156.15 53.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 O-C-N 123.741 0.651 . . . . 0.0 110.986 175.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -66.81 140.08 54.34 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.377 2.052 . . . . 0.0 110.4 174.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -49.4 -23.58 1.57 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 174.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 p -70.78 -44.48 66.57 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.651 1.18 . . . . 0.0 112.698 173.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -79.67 -42.22 25.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.923 1.689 . . . . 0.0 111.766 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.5 t -89.73 122.22 68.28 Favored Pre-proline 0 C--O 1.245 0.865 0 C-N-CA 124.525 1.13 . . . . 0.0 111.847 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.18 146.73 94.27 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.866 2.377 . . . . 0.0 110.85 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -51.39 -29.08 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -70.2 -24.65 63.16 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.67 -17.53 17.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.446 1.899 . . . . 0.0 113.984 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -57.11 101.33 0.06 Allowed 'General case' 0 N--CA 1.463 0.186 0 O-C-N 121.307 -0.871 . . . . 0.0 111.113 173.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.8 mt -85.21 168.12 15.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 122.406 1.098 . . . . 0.0 110.815 177.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -120.59 30.6 6.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.428 1.891 . . . . 0.0 112.403 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.555 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 38.6 m-85 -67.46 -16.48 64.24 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 121.535 -0.728 . . . . 0.0 112.667 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.07 67.07 2.14 Favored Glycine 0 N--CA 1.469 0.897 0 CA-C-N 119.825 1.193 . . . . 0.0 112.831 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -164.34 25.24 0.18 Allowed Glycine 0 N--CA 1.462 0.426 0 O-C-N 120.983 -1.304 . . . . 0.0 114.276 -177.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 55.4 m -132.39 151.03 52.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.866 0.866 . . . . 0.0 111.541 175.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.9 m -53.36 -41.82 66.21 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.191 0.997 . . . . 0.0 112.941 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.0 -72.64 0.68 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.993 1.717 . . . . 0.0 109.581 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.3 p -143.97 140.62 25.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.413 1.085 . . . . 0.0 111.227 -177.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 97.4 m -79.8 137.89 37.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.043 -1.036 . . . . 0.0 109.477 172.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.67 133.22 53.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.349 1.06 . . . . 0.0 111.766 172.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.438 ' HA ' ' CD1' ' A' ' 8' ' ' PHE . 1.1 p30 -80.27 97.22 6.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 123.436 1.589 . . . . 0.0 113.937 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 mt -59.24 -41.26 88.29 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 119.785 -1.822 . . . . 0.0 110.955 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m -62.76 -34.56 77.47 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 mtpt -80.86 -38.51 28.01 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 118.017 -0.992 . . . . 0.0 112.164 176.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.0 mt -60.91 -61.37 2.63 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 124.334 1.054 . . . . 0.0 111.15 176.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.4 t -159.62 143.18 14.47 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 122.561 1.172 . . . . 0.0 110.891 -178.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -70.99 23.98 0.54 Allowed Glycine 0 CA--C 1.531 1.065 0 CA-C-O 115.697 -2.724 . . . . 0.0 115.282 176.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.4 t -42.75 -66.43 0.37 Allowed 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 121.611 2.705 . . . . 0.0 111.394 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.68 -36.68 50.99 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 176.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.74 -27.98 69.24 Favored Glycine 0 CA--C 1.534 1.245 0 CA-C-O 119.358 -0.69 . . . . 0.0 112.978 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -86.27 13.25 8.32 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.391 2.276 . . . . 0.0 113.318 173.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.34 37.16 54.53 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-N 118.252 0.478 . . . . 0.0 113.055 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.14 162.18 13.19 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 125.639 1.59 . . . . 0.0 113.466 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -142.95 150.12 39.29 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 124.756 1.222 . . . . 0.0 109.894 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 96.5 m -61.89 114.46 3.37 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.388 -0.82 . . . . 0.0 111.8 174.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -116.14 148.23 41.06 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.521 1.128 . . . . 0.0 111.015 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.48 152.26 78.85 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.774 2.316 . . . . 0.0 111.186 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.5 mt -60.75 -20.92 62.38 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.98 -20.26 59.74 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.528 1.531 . . . . 0.0 112.468 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -86.03 128.17 34.81 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 120.781 -1.199 . . . . 0.0 109.959 176.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.82 118.87 23.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.493 0.717 . . . . 0.0 110.926 174.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.19 173.86 11.89 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.516 1.126 . . . . 0.0 110.354 176.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.3 ttmt -82.33 114.32 20.72 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.84 129.77 51.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.608 1.563 . . . . 0.0 112.316 177.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 21.9 tp -85.47 136.08 33.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 120.642 -1.286 . . . . 0.0 110.067 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -54.12 -38.1 65.06 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.695 -1.253 . . . . 0.0 113.982 172.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.48 -33.53 74.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.025 0.93 . . . . 0.0 110.546 177.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -79.32 -33.02 43.51 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.232 1.013 . . . . 0.0 112.206 178.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 p -55.07 -28.86 55.54 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.224 1.01 . . . . 0.0 113.477 176.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.84 -35.26 77.73 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.404 1.082 . . . . 0.0 112.851 174.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.8 t -56.48 -45.54 80.88 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.877 1.271 . . . . 0.0 112.179 178.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 66.6 m -74.91 -43.11 56.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.299 0.64 . . . . 0.0 112.512 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 114.93 -146.75 18.86 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 122.414 1.008 . . . . 0.0 112.586 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -87.62 147.04 25.46 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.116 -1.226 . . . . 0.0 111.947 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.87 6.92 74.25 Favored Glycine 0 CA--C 1.538 1.51 0 N-CA-C 114.272 0.469 . . . . 0.0 114.272 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -138.51 153.45 48.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.486 1.514 . . . . 0.0 109.754 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.8 mmtp -134.14 125.49 28.02 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 126.252 1.821 . . . . 0.0 110.179 178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.56 107.81 7.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 118.988 -0.529 . . . . 0.0 110.584 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 24.9 m -98.4 157.5 16.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 123.147 0.579 . . . . 0.0 111.94 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.1 t -106.0 138.08 33.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 110.9 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.6 m95 -104.97 -56.96 2.09 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 114.881 1.438 . . . . 0.0 114.881 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.2 mp -52.03 122.71 8.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.491 0.717 . . . . 0.0 109.496 175.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 42.0 m80 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 116.3 -1.809 . . . . 0.0 111.205 177.814 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -111.58 -29.65 7.66 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.436 0.636 . . . . 0.0 110.56 -177.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -54.82 -58.77 6.23 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.303 -0.873 . . . . 0.0 111.348 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.2 p -58.01 -33.46 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 m -63.12 -28.57 70.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.217 1.007 . . . . 0.0 111.077 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.4 mmmp? -96.57 -10.59 26.89 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 173.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.52 36.73 7.86 Favored Glycine 0 CA--C 1.52 0.404 0 CA-C-O 118.488 -1.173 . . . . 0.0 112.097 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -97.41 165.44 12.01 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.763 1.282 . . . . 0.0 111.786 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.86 131.69 10.09 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 111.273 -0.731 . . . . 0.0 111.273 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.8 m -79.4 123.74 27.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 O-C-N 122.085 -0.656 . . . . 0.0 110.791 176.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.9 mt -138.62 155.01 73.7 Favored Pre-proline 0 C--O 1.218 -0.602 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.725 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -63.77 139.79 70.7 Favored 'Trans proline' 0 C--O 1.219 -0.44 0 C-N-CA 124.333 3.355 . . . . 0.0 110.488 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -51.62 -26.98 9.95 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 176.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 m -65.57 -46.81 78.05 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.893 0.877 . . . . 0.0 113.155 170.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -75.97 -36.59 59.2 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.509 0.723 . . . . 0.0 112.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.4 t -89.24 121.37 69.52 Favored Pre-proline 0 C--O 1.241 0.632 0 O-C-N 121.089 -1.007 . . . . 0.0 111.823 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -62.96 146.96 95.03 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.651 2.234 . . . . 0.0 110.545 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -52.05 -19.72 2.04 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.91 -32.54 27.21 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.637 1.175 . . . . 0.0 113.052 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.81 -20.58 25.89 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.078 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 60.0 mtt180 -55.24 119.27 5.28 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.429 0.692 . . . . 0.0 110.078 175.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.0 mt -102.71 175.92 5.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.791 0.805 . . . . 0.0 110.272 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.3 29.85 7.55 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.26 1.024 . . . . 0.0 111.593 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -67.93 -18.36 64.74 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 121.341 -0.849 . . . . 0.0 111.914 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.89 49.97 67.26 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 120.734 -1.229 . . . . 0.0 112.441 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -142.7 33.65 1.85 Allowed Glycine 0 C--O 1.225 -0.458 0 CA-C-O 118.032 -1.427 . . . . 0.0 113.5 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -142.44 150.54 40.72 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.107 0.963 . . . . 0.0 111.777 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.1 m -58.67 -45.56 89.12 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 123.765 0.666 . . . . 0.0 111.416 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 58.4 p -105.66 -75.79 0.62 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.222 0.609 . . . . 0.0 109.594 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.7 p -148.16 148.0 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 126.014 1.726 . . . . 0.0 110.49 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.85 131.34 35.85 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.127 -0.983 . . . . 0.0 110.891 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.22 139.11 45.73 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.384 1.074 . . . . 0.0 111.737 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -81.09 101.2 9.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.808 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.47 -19.42 64.72 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.246 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.0 t -68.69 -38.16 80.1 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 120.105 1.32 . . . . 0.0 112.336 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.1 mtmt -88.39 -36.56 16.48 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 122.792 0.437 . . . . 0.0 112.014 177.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -71.87 -47.88 49.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 123.086 0.554 . . . . 0.0 111.628 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 79.0 p -130.64 -175.02 3.52 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 122.442 1.115 . . . . 0.0 111.076 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -125.56 -41.42 0.35 Allowed Glycine 0 C--O 1.221 -0.682 0 CA-C-O 118.057 -1.413 . . . . 0.0 112.369 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.7 t -44.86 -50.38 10.38 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.536 1.168 . . . . 0.0 111.709 -177.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -64.06 -47.47 80.04 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 123.84 0.856 . . . . 0.0 112.99 176.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.1 -39.3 63.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.889 0.757 . . . . 0.0 113.083 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.0 mttm -79.31 11.92 2.66 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.444 1.098 . . . . 0.0 113.487 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.8 39.43 96.76 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.171 0.891 . . . . 0.0 112.292 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.69 172.17 46.07 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 121.954 0.752 . . . . 0.0 112.376 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -136.16 150.1 48.91 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 123.012 1.386 . . . . 0.0 112.434 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.5 t -79.17 135.69 36.88 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 120.753 -1.217 . . . . 0.0 111.662 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -133.28 148.06 67.51 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 124.061 0.944 . . . . 0.0 111.23 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.94 159.13 54.29 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.657 2.238 . . . . 0.0 110.896 177.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 28.7 mt -61.92 -16.73 53.08 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -84.61 -13.51 51.42 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 123.617 1.675 . . . . 0.0 111.963 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -92.83 130.59 38.39 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 118.783 -2.448 . . . . 0.0 110.246 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -85.12 121.55 28.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.333 176.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.496 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 1.8 t -162.1 176.44 10.69 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.903 0.881 . . . . 0.0 110.688 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.3 ttmt -94.87 108.25 20.28 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.04 0.936 . . . . 0.0 111.611 175.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.83 132.04 53.38 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.766 1.226 . . . . 0.0 111.094 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.6 tp -77.69 137.7 38.65 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.009 -1.057 . . . . 0.0 109.593 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -53.34 -40.15 64.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.754 -1.216 . . . . 0.0 113.521 173.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.66 -24.19 63.58 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.878 0.871 . . . . 0.0 111.828 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -88.98 -31.06 18.31 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.467 1.107 . . . . 0.0 112.596 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 51.6 p -53.83 -28.04 33.28 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.828 1.251 . . . . 0.0 112.024 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.46 74.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.391 1.076 . . . . 0.0 112.332 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 m -56.93 -56.94 15.18 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.862 1.265 . . . . 0.0 111.307 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.33 -43.78 96.1 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.02 171.74 19.49 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 122.917 1.287 . . . . 0.0 112.271 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -56.58 135.41 54.71 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.464 -1.021 . . . . 0.0 110.764 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 86.28 9.87 75.45 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.852 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -144.56 169.05 18.71 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 110.795 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -131.77 156.62 45.66 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.558 1.543 . . . . 0.0 110.878 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.9 t -121.3 95.23 4.6 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.218 0.607 . . . . 0.0 111.545 -178.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.1 t -83.65 162.95 20.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -115.34 144.66 22.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 124.621 1.168 . . . . 0.0 111.213 174.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.496 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 33.3 m95 -112.85 178.3 4.33 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 122.28 1.038 . . . . 0.0 112.586 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.85 167.41 2.83 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.011 173.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 16.0 p80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 114.698 -2.572 . . . . 0.0 115.148 174.718 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.471 0.621 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -135.23 -22.66 1.53 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 122.064 0.935 . . . . 0.0 109.997 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.463 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 61.5 m -57.38 -55.27 36.93 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 120.546 -1.346 . . . . 0.0 110.83 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -59.31 -29.65 42.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 122.606 0.363 . . . . 0.0 111.913 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -70.44 -27.88 64.59 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.687 0.795 . . . . 0.0 111.119 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.466 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 22.4 mmmt -95.5 -3.64 46.32 Favored 'General case' 0 C--N 1.338 0.106 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.7 42.25 11.64 Favored Glycine 0 C--O 1.225 -0.463 0 O-C-N 124.348 1.03 . . . . 0.0 111.323 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.458 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 38.3 m-85 -106.36 162.31 13.8 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 124.254 1.021 . . . . 0.0 111.581 176.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.49 140.68 16.21 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.879 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.9 m -79.97 117.11 20.52 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 122.885 0.474 . . . . 0.0 111.398 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 53.2 mt -132.35 154.43 81.59 Favored Pre-proline 0 C--O 1.214 -0.791 0 O-C-N 123.576 0.547 . . . . 0.0 111.722 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -64.54 140.96 71.44 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 123.794 2.996 . . . . 0.0 110.622 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -51.2 -25.48 5.53 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 177.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 91.3 p -68.8 -46.91 67.43 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 171.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -72.64 -34.51 67.34 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.886 0.874 . . . . 0.0 111.911 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.6 t -92.84 126.65 50.82 Favored Pre-proline 0 CA--C 1.539 0.55 0 O-C-N 120.884 -1.135 . . . . 0.0 111.917 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -63.82 147.36 92.32 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.609 2.206 . . . . 0.0 110.671 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -19.53 3.71 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 172.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -81.73 -31.82 31.85 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 123.893 0.877 . . . . 0.0 112.197 175.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.89 -24.62 23.59 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -45.97 117.56 1.56 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.619 0.768 . . . . 0.0 110.376 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.7 mt -103.22 174.61 5.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.337 1.065 . . . . 0.0 109.995 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -128.1 31.46 5.07 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.732 0.813 . . . . 0.0 111.177 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.466 ' CE1' ' HG3' ' A' ' 6' ' ' LYS . 33.0 m-85 -69.0 -17.53 63.93 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 121.226 -0.921 . . . . 0.0 112.065 177.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.36 88.03 0.05 OUTLIER Glycine 0 CA--C 1.532 1.104 0 CA-C-O 124.51 2.172 . . . . 0.0 111.857 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.24 25.97 0.03 OUTLIER Glycine 0 C--O 1.224 -0.506 0 O-C-N 119.909 -1.936 . . . . 0.0 113.652 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 67.7 m -137.24 149.79 47.4 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 123.415 0.686 . . . . 0.0 111.454 177.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -61.86 -42.6 99.24 Favored 'General case' 0 C--O 1.222 -0.371 0 O-C-N 124.364 1.04 . . . . 0.0 111.291 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.5 p -107.67 -75.19 0.64 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.395 0.678 . . . . 0.0 110.245 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.4 p -151.05 143.6 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.919 1.343 . . . . 0.0 111.06 179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 91.9 m -82.0 124.17 29.55 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.279 -1.513 . . . . 0.0 110.259 173.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.89 142.99 33.44 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 122.315 1.055 . . . . 0.0 111.407 174.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.458 ' HA ' ' CD1' ' A' ' 8' ' ' PHE . 1.9 p30 -81.03 100.71 9.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 124.247 1.975 . . . . 0.0 113.731 177.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 mt -65.89 -27.84 68.5 Favored 'General case' 0 C--O 1.218 -0.557 0 O-C-N 118.733 -2.479 . . . . 0.0 111.723 -178.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.1 t -70.54 -24.26 62.77 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.3 1.04 . . . . 0.0 112.888 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -96.2 -34.39 11.67 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.469 0.708 . . . . 0.0 110.403 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -67.59 -56.73 8.29 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 62.0 p -146.97 -176.55 5.25 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 122.184 0.992 . . . . 0.0 112.1 -177.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -101.91 -42.42 2.27 Favored Glycine 0 C--O 1.219 -0.814 0 CA-C-O 117.993 -1.448 . . . . 0.0 112.154 177.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.4 t -41.9 -52.7 4.01 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.987 1.393 . . . . 0.0 112.377 -177.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.3 mttt -83.13 -37.6 23.53 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.777 175.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.41 -34.22 33.71 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.524 0.583 . . . . 0.0 113.958 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.6 mmtt -85.68 15.28 4.82 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.198 1.399 . . . . 0.0 113.024 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.72 36.89 93.93 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 123.735 0.683 . . . . 0.0 112.243 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.82 177.49 21.88 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 121.876 0.709 . . . . 0.0 112.192 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -142.28 152.77 43.33 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.7 1.238 . . . . 0.0 111.819 178.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.9 t -66.49 128.77 37.5 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 111.948 175.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -125.23 148.0 59.23 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 122.284 1.04 . . . . 0.0 111.793 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.04 156.23 65.86 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.287 1.992 . . . . 0.0 111.147 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.408 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 9.7 mt -65.16 -18.07 65.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 176.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -85.4 -9.6 57.33 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.402 0.681 . . . . 0.0 112.09 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -93.36 131.21 38.73 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 120.871 -1.143 . . . . 0.0 110.052 176.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -78.8 121.71 25.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.27 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.4 t -168.34 174.56 6.93 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 123.916 0.886 . . . . 0.0 110.055 176.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -92.51 124.45 36.55 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.458 1.103 . . . . 0.0 111.127 173.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -125.91 131.8 52.25 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 125.686 1.594 . . . . 0.0 110.687 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 12.3 tp -91.21 135.22 33.94 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.562 -0.711 . . . . 0.0 109.808 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -51.0 -40.25 57.7 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 175.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.01 64.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.142 0.977 . . . . 0.0 111.863 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -95.93 -33.53 12.15 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.67 1.188 . . . . 0.0 110.428 -178.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.1 m -53.53 -30.6 42.46 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.185 0.994 . . . . 0.0 111.37 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.87 63.42 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.82 0.848 . . . . 0.0 112.937 174.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.5 t -58.01 -58.05 10.11 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.705 0.802 . . . . 0.0 111.378 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 97.9 m -71.69 -47.25 55.42 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.964 0.412 . . . . 0.0 111.559 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -150.51 18.51 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-O 123.36 1.533 . . . . 0.0 112.38 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -78.29 145.52 35.33 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 120.249 -1.736 . . . . 0.0 111.354 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.71 0.63 85.16 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 119.31 -0.717 . . . . 0.0 113.544 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -149.21 149.31 30.77 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.219 1.007 . . . . 0.0 110.713 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.408 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -132.09 138.86 48.3 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.472 0.709 . . . . 0.0 110.29 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.5 t -77.59 131.45 37.83 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.877 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.515 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.1 OUTLIER -120.25 150.62 40.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 119.676 1.125 . . . . 0.0 110.386 177.333 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.41 141.31 46.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 123.555 0.742 . . . . 0.0 110.308 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.515 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 11.7 m95 -109.67 174.4 5.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 122.023 0.916 . . . . 0.0 111.975 175.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.0 pp -77.65 141.89 39.17 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.114 174.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 57.2 t-80 . . . . . 0 CA--C 1.554 1.1 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 175.034 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 N--CA 1.485 1.287 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -94.47 -36.75 11.74 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.462 0.476 . . . . 0.0 111.457 -174.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.7 m -51.97 -55.97 17.12 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 121.136 -0.977 . . . . 0.0 111.136 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.6 p -56.93 -34.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 175.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.0 t -63.02 -27.17 69.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.068 1.347 . . . . 0.0 112.409 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -96.74 -9.7 28.39 Favored 'General case' 0 C--N 1.34 0.176 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 171.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 85.89 29.66 25.49 Favored Glycine 0 CA--C 1.525 0.668 0 CA-C-O 117.826 -1.541 . . . . 0.0 112.989 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -88.81 168.88 12.09 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.065 1.433 . . . . 0.0 113.194 175.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.42 129.79 8.64 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.494 1.045 . . . . 0.0 111.623 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.2 m -77.16 132.4 38.78 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.053 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.3 mt -142.59 162.68 43.2 Favored Pre-proline 0 N--CA 1.469 0.513 0 O-C-N 124.327 1.017 . . . . 0.0 111.152 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -70.48 140.92 41.06 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.536 2.157 . . . . 0.0 111.127 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -55.4 -20.86 13.39 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.1 t -67.63 -48.47 66.64 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.902 1.281 . . . . 0.0 113.444 169.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -73.58 -44.68 56.7 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-O 123.173 1.463 . . . . 0.0 112.18 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.8 t -79.34 116.63 61.94 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 119.851 -1.78 . . . . 0.0 112.874 -178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.67 154.12 71.08 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.012 1.808 . . . . 0.0 111.918 -177.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -28.4 22.22 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -81.68 -18.96 42.67 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.624 1.97 . . . . 0.0 113.114 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.71 -21.72 17.42 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 116.206 -1.854 . . . . 0.0 113.098 172.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -54.91 111.78 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.192 1.36 . . . . 0.0 111.335 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.6 mt -94.8 174.61 7.02 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.713 0.768 . . . . 0.0 109.921 -178.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.2 m -118.24 25.49 10.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.921 1.288 . . . . 0.0 112.675 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -66.03 -20.81 66.3 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-O 117.701 -1.143 . . . . 0.0 112.151 174.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.9 73.25 0.45 Allowed Glycine 0 N--CA 1.476 1.308 0 CA-C-N 121.107 1.776 . . . . 0.0 112.667 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -177.38 29.02 0.07 OUTLIER Glycine 0 C--O 1.23 -0.132 0 O-C-N 120.674 -1.486 . . . . 0.0 113.266 -174.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.6 m -129.58 157.75 41.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.631 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.0 t -44.19 -47.28 9.17 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.067 1.479 . . . . 0.0 112.664 -177.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -131.49 -59.3 0.97 Allowed 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.322 1.449 . . . . 0.0 110.21 177.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.4 p -140.33 153.3 21.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 122.676 1.227 . . . . 0.0 110.919 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.4 t -93.78 137.02 33.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.101 174.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -113.17 140.09 48.21 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 122.509 1.147 . . . . 0.0 112.523 176.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -81.09 101.25 9.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.79 -1.095 . . . . 0.0 111.523 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -62.64 -37.92 88.24 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.644 -1.17 . . . . 0.0 112.127 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.4 t -59.47 -37.07 77.26 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.361 1.464 . . . . 0.0 112.414 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.5 mtmp? -84.74 -34.63 22.82 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 175.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 28.3 mt -60.84 -61.12 2.81 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.744 0.817 . . . . 0.0 109.766 177.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.1 p -149.19 164.76 33.84 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 122.98 1.371 . . . . 0.0 112.566 -177.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -78.03 -35.55 34.39 Favored Glycine 0 CA--C 1.526 0.751 0 O-C-N 119.561 -1.962 . . . . 0.0 111.99 175.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.7 t -46.4 -47.97 18.75 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 119.043 1.422 . . . . 0.0 112.877 -171.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -85.27 -37.84 19.56 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.667 1.187 . . . . 0.0 112.76 175.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.35 54.84 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.98 1.276 . . . . 0.0 114.216 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -81.78 12.29 4.11 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.766 1.626 . . . . 0.0 114.28 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.5 22.26 76.44 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.785 1.183 . . . . 0.0 114.49 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.96 -175.81 30.63 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.506 1.051 . . . . 0.0 112.626 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.13 149.65 29.73 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.227 1.011 . . . . 0.0 111.504 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.29 130.59 47.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 120.998 -1.064 . . . . 0.0 112.442 172.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -128.46 151.89 77.41 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.75 0.82 . . . . 0.0 111.435 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.03 153.63 67.47 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.506 2.137 . . . . 0.0 110.616 176.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.98 -20.46 62.44 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -73.93 -18.92 60.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.511 1.524 . . . . 0.0 113.399 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -86.72 129.57 34.82 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 120.512 -1.367 . . . . 0.0 109.834 174.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -79.64 125.37 29.53 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.94 170.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.36 174.15 3.96 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.4 1.08 . . . . 0.0 110.703 175.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -86.54 124.26 32.64 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.208 1.003 . . . . 0.0 110.451 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -124.33 139.03 54.29 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.097 1.498 . . . . 0.0 112.09 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.89 148.98 22.83 Favored 'General case' 0 C--O 1.22 -0.485 0 O-C-N 120.801 -1.187 . . . . 0.0 109.645 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -64.15 -40.05 95.32 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.399 -0.813 . . . . 0.0 112.369 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.79 -32.55 59.93 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.61 -36.73 28.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.612 -0.68 . . . . 0.0 112.72 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.2 m -54.38 -29.42 48.57 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.116 1.367 . . . . 0.0 112.26 175.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.14 86.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 117.963 -1.018 . . . . 0.0 112.94 174.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t -44.13 -58.04 3.07 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.791 2.037 . . . . 0.0 112.074 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -80.36 -56.2 4.36 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.878 172.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 42.57 -147.54 0.64 Allowed Glycine 0 C--N 1.35 1.326 0 C-N-CA 127.247 2.356 . . . . 0.0 112.353 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt 49.09 46.47 22.61 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 119.837 1.819 . . . . 0.0 114.277 174.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.77 23.0 62.91 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 121.266 -0.896 . . . . 0.0 114.201 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -132.24 159.47 38.96 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 126.379 1.872 . . . . 0.0 110.086 177.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -137.98 124.33 20.6 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 126.439 1.895 . . . . 0.0 109.835 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.53 125.94 28.24 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.517 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.1 m -120.08 137.79 53.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 120.055 1.298 . . . . 0.0 111.798 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.1 p -106.79 144.52 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 122.12 0.962 . . . . 0.0 110.395 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -111.37 177.72 4.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.82 1.248 . . . . 0.0 111.956 172.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.6 pp -104.87 27.53 8.01 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.598 1.559 . . . . 0.0 113.702 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 115.436 -2.221 . . . . 0.0 113.169 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -113.58 -38.95 4.18 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.884 0.74 . . . . 0.0 111.939 -171.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.2 m -47.86 -54.95 10.94 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.07 -1.019 . . . . 0.0 111.863 173.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 p -57.41 -34.09 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.065 1.346 . . . . 0.0 112.795 176.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 t -64.5 -29.48 70.52 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.33 1.452 . . . . 0.0 111.73 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -94.37 -3.55 50.12 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 172.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 78.01 35.26 35.31 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-N 118.797 0.726 . . . . 0.0 113.073 -176.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.486 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 39.0 m-85 -99.19 166.3 11.3 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.949 1.3 . . . . 0.0 112.466 173.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 143.62 17.53 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.255 0.931 . . . . 0.0 111.308 179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.82 131.38 35.26 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.724 -0.868 . . . . 0.0 110.861 174.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -141.51 156.84 66.61 Favored Pre-proline 0 N--CA 1.471 0.589 0 C-N-CA 123.536 0.734 . . . . 0.0 111.144 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.69 139.28 62.61 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.731 2.287 . . . . 0.0 110.727 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -53.28 -18.84 2.68 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 175.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -71.31 -47.11 58.7 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.415 1.886 . . . . 0.0 111.902 170.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.69 -36.07 44.16 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.573 1.149 . . . . 0.0 111.993 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.7 t -88.17 112.03 46.86 Favored Pre-proline 0 C--O 1.246 0.869 0 C-N-CA 123.878 0.871 . . . . 0.0 111.668 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.91 153.96 64.79 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 123.033 2.489 . . . . 0.0 110.937 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -50.47 -35.07 27.34 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.026 -1.046 . . . . 0.0 113.798 175.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -71.1 -20.76 62.3 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.341 1.056 . . . . 0.0 113.378 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.85 -19.21 16.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.372 1.869 . . . . 0.0 114.656 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -61.17 115.54 3.87 Favored 'General case' 0 CA--C 1.522 -0.104 0 O-C-N 121.25 -0.906 . . . . 0.0 109.982 173.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.9 mt -100.64 166.78 10.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.721 0.772 . . . . 0.0 110.846 178.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.32 27.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.811 1.244 . . . . 0.0 112.573 177.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -65.46 -22.47 66.75 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.117 -0.989 . . . . 0.0 112.666 175.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.61 76.95 0.2 Allowed Glycine 0 CA--C 1.532 1.096 0 CA-C-N 120.025 1.284 . . . . 0.0 113.696 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -175.25 31.63 0.09 OUTLIER Glycine 0 N--CA 1.464 0.501 0 O-C-N 121.141 -1.211 . . . . 0.0 113.324 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.7 m -136.98 148.24 46.79 Favored 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 124.198 0.999 . . . . 0.0 111.272 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.9 m -58.65 -41.92 87.16 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.799 0.84 . . . . 0.0 112.053 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 p -109.55 -75.19 0.63 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.401 1.08 . . . . 0.0 109.069 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 p -147.18 149.11 15.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 126.337 1.855 . . . . 0.0 109.687 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.9 t -76.98 128.13 33.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.636 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -114.36 131.45 56.55 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.403 1.081 . . . . 0.0 111.25 177.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.486 ' HA ' ' CD1' ' A' ' 8' ' ' PHE . 1.5 p30 -84.58 97.7 9.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 124.186 1.946 . . . . 0.0 113.219 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.0 mt -54.67 -35.53 63.63 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.161 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.1 m -65.16 -29.37 70.2 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.6 mtpp -86.58 -37.93 17.65 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.476 1.034 . . . . 0.0 112.216 174.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.9 mp -64.81 -66.14 0.58 Allowed 'General case' 0 C--N 1.342 0.276 0 C-N-CA 123.913 0.885 . . . . 0.0 110.891 175.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 t -176.02 136.49 0.3 Allowed 'General case' 0 C--O 1.24 0.571 0 CA-C-O 122.09 0.948 . . . . 0.0 112.997 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.03 -27.91 39.28 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-O 118.082 -1.399 . . . . 0.0 113.215 175.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 35.0 t -50.03 -48.46 52.73 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 118.097 0.948 . . . . 0.0 110.162 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 54.1 mttt -82.72 -36.17 26.04 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.28 -41.88 87.72 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.961 0.791 . . . . 0.0 113.765 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -83.92 16.55 2.77 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.644 1.578 . . . . 0.0 114.069 174.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.19 42.19 76.92 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.465 1.031 . . . . 0.0 114.499 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -123.08 175.06 16.56 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.043 1.782 . . . . 0.0 113.925 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -150.66 149.03 29.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.993 1.317 . . . . 0.0 111.048 -175.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -65.84 123.0 18.6 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.119 -0.988 . . . . 0.0 111.483 173.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -127.34 148.22 65.36 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 124.636 1.175 . . . . 0.0 111.22 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -68.02 157.07 63.4 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.458 2.105 . . . . 0.0 111.125 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -62.07 -21.89 65.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -75.22 -13.07 60.41 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.255 2.222 . . . . 0.0 113.008 173.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.51 126.76 35.41 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 119.749 -1.845 . . . . 0.0 110.269 174.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -78.29 117.6 19.7 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.798 0.839 . . . . 0.0 110.076 171.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.2 t -163.06 176.87 9.64 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.333 1.453 . . . . 0.0 109.553 171.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -91.42 106.85 18.79 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 125.505 1.522 . . . . 0.0 110.147 172.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -101.3 141.94 33.44 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.037 0.922 . . . . 0.0 111.196 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 16.7 tp -89.98 134.84 34.0 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.071 -1.018 . . . . 0.0 109.526 170.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 pm0 -48.85 -44.93 40.08 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.079 1.352 . . . . 0.0 112.381 172.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.35 -23.64 64.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.715 1.206 . . . . 0.0 112.752 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -90.4 -39.02 12.92 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.947 1.299 . . . . 0.0 112.935 177.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.1 p -54.21 -28.5 41.29 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.936 -1.103 . . . . 0.0 112.603 173.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.78 -36.42 69.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.462 1.505 . . . . 0.0 113.157 175.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.3 m -70.63 -48.52 54.58 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.603 1.161 . . . . 0.0 113.281 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 17.3 m -62.29 -40.03 94.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.14 -176.35 25.63 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 122.616 1.12 . . . . 0.0 112.859 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -63.95 143.24 58.01 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.988 -1.301 . . . . 0.0 111.571 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.06 10.62 85.98 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 119.133 -0.815 . . . . 0.0 114.385 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -137.15 160.59 38.55 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.624 1.57 . . . . 0.0 110.694 177.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -137.83 117.32 12.91 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.312 1.845 . . . . 0.0 110.543 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.0 t -74.73 97.59 3.27 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.815 -0.553 . . . . 0.0 110.967 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -77.31 161.67 27.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.605 1.562 . . . . 0.0 110.821 173.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.7 t -123.67 134.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.035 1.334 . . . . 0.0 109.745 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -107.92 -63.52 1.31 Allowed 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.353 1.061 . . . . 0.0 112.065 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.0 mp -72.32 147.04 46.73 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 . . . . . 0 C--O 1.255 1.356 0 CA-C-O 116.196 -1.859 . . . . 0.0 114.411 177.926 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . 0.478 HD21 ' N ' ' A' ' 2' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.478 ' N ' HD21 ' A' ' 1' ' ' ASN . 3.9 mm-40 -116.9 -44.64 2.81 Favored 'General case' 0 C--O 1.22 -0.475 0 O-C-N 123.612 0.57 . . . . 0.0 109.728 -176.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.4 m -47.8 -55.92 8.58 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.658 -0.651 . . . . 0.0 111.284 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.5 p -58.91 -31.06 44.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.017 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.1 t -63.72 -30.12 71.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.727 0.811 . . . . 0.0 110.544 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.485 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 27.0 mmtt -96.18 -9.23 31.03 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.26 29.17 25.79 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 119.195 -0.78 . . . . 0.0 111.906 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 61.8 m-85 -89.75 168.74 11.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 118.331 1.065 . . . . 0.0 111.715 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.66 126.66 6.92 Favored Glycine 0 CA--C 1.519 0.306 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.546 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.0 m -75.78 139.43 41.8 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.95 -0.735 . . . . 0.0 111.076 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.5 mt -154.99 155.0 29.78 Favored Pre-proline 0 C--O 1.206 -1.202 0 O-C-N 124.19 0.931 . . . . 0.0 112.051 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.06 133.95 30.4 Favored 'Trans proline' 0 CA--C 1.506 -0.916 0 C-N-CA 123.98 3.12 . . . . 0.0 111.116 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.411 ' CG ' HG13 ' A' ' 30' ' ' VAL . 63.2 mt-30 -47.34 -27.83 1.77 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 123.191 0.596 . . . . 0.0 111.397 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.6 p -59.73 -47.43 85.7 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -83.12 -30.89 27.55 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.338 0.59 . . . . 0.0 112.46 177.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 17.7 t -93.19 126.63 50.1 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 121.71 -0.619 . . . . 0.0 111.694 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.409 ' HG2' ' CB ' ' A' ' 20' ' ' ALA . 50.0 Cg_endo -67.49 153.01 77.81 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.855 2.37 . . . . 0.0 112.265 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -52.91 -35.08 57.72 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -73.23 -16.34 61.41 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 123.927 0.891 . . . . 0.0 111.13 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.409 ' CB ' ' HG2' ' A' ' 17' ' ' PRO . . . -95.29 -30.26 14.05 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 124.072 0.858 . . . . 0.0 113.052 177.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -54.27 113.01 1.1 Allowed 'General case' 0 C--N 1.334 -0.069 0 O-C-N 121.584 -0.698 . . . . 0.0 110.07 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 13.0 mt -96.33 177.92 5.54 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.776 0.798 . . . . 0.0 110.2 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.8 p -122.38 34.58 5.11 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.385 0.674 . . . . 0.0 111.391 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.443 ' CZ ' ' CE2' ' A' ' 8' ' ' PHE . 59.1 m-85 -73.82 -16.87 61.13 Favored 'General case' 0 C--O 1.203 -1.379 0 O-C-N 122.092 -0.38 . . . . 0.0 110.84 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.6 80.99 0.07 OUTLIER Glycine 0 C--O 1.219 -0.839 0 CA-C-O 122.439 1.021 . . . . 0.0 111.905 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.2 26.07 0.04 OUTLIER Glycine 0 C--O 1.223 -0.538 0 O-C-N 120.796 -1.414 . . . . 0.0 112.795 -179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 56.2 m -124.44 156.98 36.27 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 117.02 0.41 . . . . 0.0 111.533 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -48.9 -44.73 40.43 Favored 'General case' 0 C--O 1.223 -0.338 0 O-C-N 123.923 0.765 . . . . 0.0 111.122 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.2 t -132.34 -60.3 0.9 Allowed 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.601 0.76 . . . . 0.0 110.965 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.411 HG13 ' CG ' ' A' ' 13' ' ' GLN . 13.9 p -145.35 140.29 22.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 CA-C-O 121.847 0.832 . . . . 0.0 110.988 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 1.3 t -82.63 140.57 33.1 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.291 -0.88 . . . . 0.0 111.969 176.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -116.19 130.07 56.61 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.835 1.302 . . . . 0.0 110.742 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.16 106.39 7.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 123.128 1.442 . . . . 0.0 112.146 177.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mt -64.94 -37.7 88.53 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 119.271 -2.143 . . . . 0.0 110.182 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 m -53.18 -32.8 49.72 Favored 'General case' 0 CA--C 1.528 0.123 0 O-C-N 121.803 -0.56 . . . . 0.0 112.05 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.1 mttt -90.65 -32.48 16.2 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.32 -70.46 0.47 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 123.288 0.635 . . . . 0.0 109.745 -178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.8 t -140.21 145.9 37.99 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 123.242 1.496 . . . . 0.0 112.145 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -84.56 33.44 3.24 Favored Glycine 0 N--CA 1.451 -0.348 0 O-C-N 119.685 -1.884 . . . . 0.0 112.69 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.3 t -56.84 -39.4 74.19 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 118.138 0.969 . . . . 0.0 110.717 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -80.86 -29.8 35.73 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 121.516 0.674 . . . . 0.0 112.108 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -69.42 -36.19 77.3 Favored Glycine 0 C--N 1.336 0.544 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.0 mttt -78.61 12.67 1.94 Allowed 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.58 42.08 14.63 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.788 -0.525 . . . . 0.0 111.788 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -115.65 169.39 12.91 Favored Glycine 0 CA--C 1.518 0.244 0 CA-C-N 117.033 0.417 . . . . 0.0 112.774 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -149.74 155.91 40.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.833 0.825 . . . . 0.0 112.127 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 t -73.71 130.8 40.73 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.102 -0.999 . . . . 0.0 112.456 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -135.76 148.44 65.35 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 121.598 0.713 . . . . 0.0 112.063 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.18 159.22 54.08 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.506 2.138 . . . . 0.0 111.508 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.431 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 14.4 mt -60.96 -15.84 35.92 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.55 -10.63 57.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.058 0.543 . . . . 0.0 111.455 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.46 129.15 41.34 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 121.775 0.798 . . . . 0.0 109.877 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -80.45 120.51 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.715 176.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -172.83 170.53 4.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.456 0.646 . . . . 0.0 111.169 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 tttt -83.08 111.13 18.6 Favored 'General case' 0 CA--C 1.522 -0.121 0 O-C-N 121.859 -0.525 . . . . 0.0 110.456 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -117.87 128.96 55.34 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.746 0.784 . . . . 0.0 111.293 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.7 mt -84.82 156.39 21.35 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.589 -0.694 . . . . 0.0 110.636 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -69.61 -33.95 73.39 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.351 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.47 -31.05 33.17 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 120.82 0.343 . . . . 0.0 111.813 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -80.45 -30.98 37.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.983 0.42 . . . . 0.0 111.007 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 93.6 p -55.31 -37.87 67.93 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.628 -0.67 . . . . 0.0 111.588 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.96 -36.69 72.92 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 123.525 0.516 . . . . 0.0 112.074 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.0 t -54.42 -54.37 41.69 Favored 'General case' 0 C--N 1.334 -0.108 0 O-C-N 123.411 0.444 . . . . 0.0 111.474 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 8.8 m -57.06 -49.97 74.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.377 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 116.21 175.6 17.92 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-O 122.496 1.053 . . . . 0.0 112.067 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -61.4 129.24 40.25 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.329 -1.101 . . . . 0.0 110.436 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.36 6.58 70.79 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 113.483 -179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -141.93 162.5 35.31 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.395 0.617 . . . . 0.0 110.951 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.431 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 64.5 mmtt -138.49 138.75 38.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 122.133 0.968 . . . . 0.0 111.93 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -84.49 106.04 15.76 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.583 -0.698 . . . . 0.0 110.672 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.33 156.17 21.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.674 0.75 . . . . 0.0 111.795 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.12 144.65 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 C-N-CA 123.226 0.61 . . . . 0.0 111.18 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -118.72 -179.9 3.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.541 0.686 . . . . 0.0 111.853 176.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.0 pp -124.73 171.45 10.09 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.377 0.671 . . . . 0.0 111.878 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.3 t60 . . . . . 0 C--O 1.248 0.987 0 CA-C-O 116.966 -1.492 . . . . 0.0 111.935 176.816 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.479 1.016 0 CA-C-O 118.197 -0.906 . . . . 0.0 109.157 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -116.48 -28.92 6.31 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 123.644 0.59 . . . . 0.0 111.004 -173.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.2 m -53.67 -48.24 69.65 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.513 -1.367 . . . . 0.0 111.829 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -56.43 -27.1 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.552 1.141 . . . . 0.0 113.187 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 t -66.8 -35.19 79.49 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.875 1.27 . . . . 0.0 111.287 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.42 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 3.6 mmmm -96.9 -7.65 32.79 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 174.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.25 44.35 7.05 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.203 0.906 . . . . 0.0 112.396 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.42 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 35.6 m-85 -108.65 163.31 13.36 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.091 1.356 . . . . 0.0 112.169 176.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.77 145.29 18.4 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.276 0.941 . . . . 0.0 111.382 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.5 m -83.13 136.3 34.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.7 -0.883 . . . . 0.0 112.025 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.1 mt -148.6 155.83 41.8 Favored Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.738 0.815 . . . . 0.0 111.857 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.53 142.69 79.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.431 2.087 . . . . 0.0 110.884 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -52.54 -21.18 3.54 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 175.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 t -74.17 -46.96 38.92 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.102 1.761 . . . . 0.0 112.868 170.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -68.37 -50.27 54.28 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.276 1.03 . . . . 0.0 110.775 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.53 118.21 70.55 Favored Pre-proline 0 C--O 1.246 0.88 0 O-C-N 121.566 -0.709 . . . . 0.0 111.535 -174.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.02 151.06 86.67 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.793 2.329 . . . . 0.0 110.847 -177.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -52.33 -24.32 7.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -79.55 -28.73 41.21 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.367 1.467 . . . . 0.0 113.989 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -24.47 22.4 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.562 1.145 . . . . 0.0 111.206 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -48.32 117.99 2.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.412 0.685 . . . . 0.0 110.885 174.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 19.5 mt -99.77 172.08 7.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.923 0.868 . . . . 0.0 110.455 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.6 p -100.65 11.29 39.83 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.848 1.659 . . . . 0.0 112.985 177.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.418 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 54.4 m-85 -77.44 -11.74 59.88 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.133 -0.98 . . . . 0.0 112.2 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.72 -106.23 0.57 Allowed Glycine 0 C--O 1.216 -1.0 0 CA-C-O 116.771 -2.127 . . . . 0.0 110.176 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 39.48 28.04 0.1 Allowed Glycine 0 N--CA 1.474 1.21 0 C-N-CA 127.342 2.401 . . . . 0.0 115.419 175.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.0 m -145.67 146.71 31.4 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.441 1.496 . . . . 0.0 108.972 -169.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 m -68.66 -22.71 64.38 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 p -127.0 -75.86 0.58 Allowed 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 125.943 1.697 . . . . 0.0 110.659 -175.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -148.58 150.44 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 O-C-N 121.312 -0.868 . . . . 0.0 110.863 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 t -78.77 129.44 34.64 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 121.516 -0.74 . . . . 0.0 110.354 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.83 140.21 46.67 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.245 1.022 . . . . 0.0 112.964 177.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -88.98 104.31 16.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.262 1.029 . . . . 0.0 110.987 -178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.7 mt -58.37 -33.11 69.21 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.022 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 t -68.24 -31.13 70.4 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.122 1.369 . . . . 0.0 111.868 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt -84.99 -38.78 18.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.808 1.243 . . . . 0.0 111.89 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.0 mt -61.06 -60.21 4.14 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.089 0.955 . . . . 0.0 111.011 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.2 t -171.39 155.64 4.28 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 122.16 0.981 . . . . 0.0 113.564 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.89 -29.06 71.34 Favored Glycine 0 CA--C 1.534 1.275 0 O-C-N 120.28 -1.513 . . . . 0.0 113.786 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.5 t -52.09 -47.37 65.27 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.395 1.597 . . . . 0.0 110.233 -174.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt -86.3 -38.27 17.69 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.606 1.162 . . . . 0.0 113.194 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.99 -42.85 54.94 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 124.157 0.884 . . . . 0.0 113.601 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.529 ' HE3' ' OE1' ' A' ' 60' ' ' GLU . 7.6 mtmp? -78.99 15.44 1.11 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.033 1.733 . . . . 0.0 113.928 173.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.11 32.67 83.21 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.251 1.881 . . . . 0.0 114.42 -176.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -97.14 170.99 26.52 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-O 122.779 1.211 . . . . 0.0 113.417 177.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.2 tt0 -138.93 150.07 45.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.148 1.379 . . . . 0.0 111.756 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 90.5 m -71.87 120.25 17.2 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 120.754 -1.216 . . . . 0.0 111.192 173.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -110.52 150.69 42.02 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.307 1.043 . . . . 0.0 110.661 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.04 152.45 76.63 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.635 2.224 . . . . 0.0 111.543 176.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 39.6 mt -57.59 -24.52 56.77 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -73.76 -19.58 60.74 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.163 1.785 . . . . 0.0 112.862 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -89.18 134.82 33.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 123.08 1.419 . . . . 0.0 110.744 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -96.54 120.73 37.38 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 125.069 1.348 . . . . 0.0 109.439 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.6 p -166.76 170.67 12.19 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.174 1.39 . . . . 0.0 109.953 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -73.62 108.01 6.21 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.624 1.17 . . . . 0.0 109.863 175.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.91 145.58 42.05 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.075 0.95 . . . . 0.0 109.783 174.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.02 139.75 32.56 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.176 0.59 . . . . 0.0 110.326 173.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -63.14 -42.08 99.4 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.599 -0.688 . . . . 0.0 112.525 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.05 76.98 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.592 -0.692 . . . . 0.0 111.991 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.529 ' OE1' ' HE3' ' A' ' 43' ' ' LYS . 3.8 tp10 -85.7 -33.79 21.43 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.395 1.078 . . . . 0.0 113.482 -177.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.7 p -53.11 -34.2 55.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.693 1.597 . . . . 0.0 112.377 173.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.61 -36.18 71.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.38 1.072 . . . . 0.0 111.844 176.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -48.25 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.327 1.051 . . . . 0.0 112.473 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 67.6 m -60.84 -41.97 96.85 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 122.448 0.299 . . . . 0.0 111.693 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 113.37 174.24 18.89 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 122.679 1.155 . . . . 0.0 112.732 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -64.53 129.12 38.65 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.707 0.803 . . . . 0.0 109.76 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.36 13.99 62.69 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-O 117.871 -1.516 . . . . 0.0 113.42 -177.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -139.57 156.36 46.93 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.663 1.585 . . . . 0.0 110.639 176.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -127.04 119.0 25.55 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.253 1.821 . . . . 0.0 110.118 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.2 t -76.04 104.95 6.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.415 -0.803 . . . . 0.0 111.408 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 60.9 m -101.23 161.19 13.79 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.712 0.768 . . . . 0.0 112.058 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.8 m -116.22 145.07 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.604 0.762 . . . . 0.0 110.993 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -104.88 -80.06 0.55 Allowed 'General case' 0 N--CA 1.461 0.094 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.402 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.6 mp 37.74 52.45 1.41 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.151 1.78 . . . . 0.0 113.055 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 . . . . . 0 C--O 1.248 1.008 0 C-N-CA 125.911 1.684 . . . . 0.0 110.093 -177.071 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 120.598 0.237 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -111.66 -20.75 12.01 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.302 -167.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 97.0 m -51.49 -63.18 1.22 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.275 1.03 . . . . 0.0 111.421 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.6 p -56.59 -34.81 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 112.773 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.5 t -62.64 -26.05 68.43 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.949 1.3 . . . . 0.0 112.422 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.438 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 2.6 mmpt? -99.25 -7.18 26.79 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 171.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.38 28.74 35.33 Favored Glycine 0 CA--C 1.535 1.315 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.377 -175.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -90.54 160.84 15.76 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.672 1.736 . . . . 0.0 113.649 175.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.42 123.83 7.7 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 125.771 1.653 . . . . 0.0 111.797 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -73.85 131.11 41.16 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 121.333 -1.098 . . . . 0.0 111.283 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 70.6 mt -142.19 164.19 35.11 Favored Pre-proline 0 N--CA 1.472 0.649 0 C-N-CA 123.021 0.528 . . . . 0.0 110.583 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.42 141.49 35.19 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.161 1.907 . . . . 0.0 111.656 171.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -51.02 -15.57 0.33 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.864 1.666 . . . . 0.0 115.181 173.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 t -78.27 -39.54 39.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.953 2.101 . . . . 0.0 113.021 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -86.25 -37.1 18.95 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.69 1.596 . . . . 0.0 110.924 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.3 t -92.49 116.33 66.31 Favored Pre-proline 0 C--O 1.245 0.856 0 C-N-CA 124.431 1.092 . . . . 0.0 111.921 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.76 151.22 86.49 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.541 2.161 . . . . 0.0 111.672 -175.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -53.8 -28.71 36.75 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -72.89 -19.7 61.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.697 1.199 . . . . 0.0 113.658 176.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -102.65 -16.08 16.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 128.048 2.539 . . . . 0.0 114.276 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -59.74 105.25 0.36 Allowed 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.254 -0.903 . . . . 0.0 112.2 171.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 mt -93.6 163.32 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 111.846 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 p -103.71 22.39 14.5 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.11 1.764 . . . . 0.0 114.407 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -67.79 3.51 1.44 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.964 1.706 . . . . 0.0 115.452 175.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 38.98 64.33 0.93 Allowed Glycine 0 N--CA 1.475 1.261 0 C-N-CA 126.917 2.199 . . . . 0.0 114.876 171.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -165.22 28.17 0.2 Allowed Glycine 0 C--O 1.226 -0.395 0 CA-C-O 118.738 -1.035 . . . . 0.0 113.472 -173.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.6 m -130.42 161.91 30.31 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.6 0.76 . . . . 0.0 112.422 177.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -53.54 -36.34 61.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.508 1.123 . . . . 0.0 113.549 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.29 -50.29 0.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.543 1.137 . . . . 0.0 111.074 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.9 p -147.24 149.29 15.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 122.07 0.938 . . . . 0.0 111.432 174.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.2 t -89.7 137.66 32.14 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 124.355 1.062 . . . . 0.0 108.8 172.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.16 133.18 56.27 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.105 0.962 . . . . 0.0 111.225 177.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -82.36 90.01 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 123.97 1.843 . . . . 0.0 112.679 -177.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -50.31 -33.66 20.91 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.123 1.156 . . . . 0.0 114.123 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -79.33 -11.51 59.93 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.81 -37.28 8.35 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.213 1.405 . . . . 0.0 109.911 178.265 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.29 -53.32 37.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.651 1.58 . . . . 0.0 111.753 171.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 82.6 p -141.69 179.33 6.9 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.17 0.988 . . . . 0.0 111.342 -175.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -94.02 -54.34 1.64 Allowed Glycine 0 CA--C 1.526 0.76 0 O-C-N 120.055 -1.653 . . . . 0.0 111.325 172.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.6 t -44.89 -61.82 1.46 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.861 1.664 . . . . 0.0 110.858 -172.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.441 ' HE2' ' OE2' ' A' ' 46' ' ' GLU . 34.1 mmtp -56.35 -46.31 80.02 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.371 1.468 . . . . 0.0 112.935 176.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.91 -29.77 62.4 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.116 0.865 . . . . 0.0 115.011 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -87.51 8.22 25.92 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.14 32.78 30.93 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.341 0.972 . . . . 0.0 113.422 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.8 164.03 28.65 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 124.282 0.944 . . . . 0.0 113.332 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.441 ' OE2' ' HE2' ' A' ' 41' ' ' LYS . 8.6 tp10 -152.13 151.8 31.51 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.574 1.15 . . . . 0.0 112.539 178.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 36.4 m -70.19 121.46 17.6 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.874 -1.141 . . . . 0.0 111.369 174.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -121.89 148.25 50.72 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.977 0.911 . . . . 0.0 111.784 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -69.29 155.44 67.48 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.456 2.104 . . . . 0.0 110.697 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.7 mt -60.59 -21.31 62.49 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -74.17 -20.53 60.18 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 128.258 2.623 . . . . 0.0 112.86 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -88.62 119.89 29.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.298 -1.501 . . . . 0.0 110.638 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -63.04 117.67 6.78 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.136 0.574 . . . . 0.0 111.09 168.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.9 t -155.66 -173.1 4.39 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.305 1.042 . . . . 0.0 110.055 166.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -96.84 108.1 20.71 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.201 1.8 . . . . 0.0 110.098 167.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -107.87 147.67 30.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.66 120.36 42.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.402 1.481 . . . . 0.0 110.255 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.434 ' H ' ' NE2' ' A' ' 58' ' ' GLN . 5.7 mp0 -55.36 -34.79 64.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.609 0.764 . . . . 0.0 111.685 -176.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.77 -39.4 65.35 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.693 2.397 . . . . 0.0 113.956 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -105.85 -13.73 15.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.143 1.377 . . . . 0.0 112.386 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -55.83 -37.57 68.87 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.14 -1.6 . . . . 0.0 112.108 174.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.83 -32.0 71.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.54 1.536 . . . . 0.0 113.417 173.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -63.94 -48.96 74.48 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.268 1.427 . . . . 0.0 111.971 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.9 t -67.98 -29.93 69.08 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 175.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.73 176.62 25.89 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-O 122.865 1.258 . . . . 0.0 113.672 176.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -64.68 130.76 44.79 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.841 -1.388 . . . . 0.0 111.822 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.54 4.79 60.56 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.108 0.861 . . . . 0.0 114.054 -178.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -132.82 161.23 34.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.695 1.598 . . . . 0.0 110.594 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -138.17 120.18 15.51 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.046 1.738 . . . . 0.0 110.788 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.2 t -73.25 92.17 1.75 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 122.778 0.431 . . . . 0.0 110.579 177.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.4 t -80.35 160.22 25.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.936 1.694 . . . . 0.0 110.667 177.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.8 p -133.53 143.12 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.134 0.973 . . . . 0.0 111.0 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 36.1 m95 -109.69 179.22 4.19 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.32 1.048 . . . . 0.0 110.335 177.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -59.07 148.53 30.71 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.404 -0.81 . . . . 0.0 111.544 166.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.4 ' CD2' ' C ' ' A' ' 75' ' ' HIS . 8.5 p-80 . . . . . 0 C--O 1.248 0.976 0 CA-C-O 115.981 -1.961 . . . . 0.0 112.978 169.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 118.469 -0.777 . . . . 0.0 109.142 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -108.03 -26.49 10.64 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.3 0.571 . . . . 0.0 111.256 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 73.9 m -51.32 -59.26 4.41 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 120.814 -1.179 . . . . 0.0 111.099 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.79 -32.76 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -63.11 -31.83 73.07 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.602 1.161 . . . . 0.0 110.994 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.404 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 1.4 mmpt? -95.09 -11.49 28.17 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.74 -1.124 . . . . 0.0 113.569 174.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.19 33.91 22.04 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 124.157 0.911 . . . . 0.0 112.397 -177.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -80.35 169.17 18.09 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 118.74 1.27 . . . . 0.0 112.342 175.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.84 117.58 4.08 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 123.648 0.642 . . . . 0.0 111.544 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.0 m -72.16 131.92 43.45 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.259 175.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 79.8 mt -147.87 156.39 44.32 Favored Pre-proline 0 C--O 1.218 -0.597 0 O-C-N 124.309 1.006 . . . . 0.0 111.224 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.412 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 56.1 Cg_endo -66.3 139.66 55.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.089 2.526 . . . . 0.0 111.247 175.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -52.22 -20.68 2.78 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.1 t -66.74 -48.13 70.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.948 1.299 . . . . 0.0 112.611 170.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.44 -38.1 42.06 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.157 0.983 . . . . 0.0 111.361 177.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -87.61 125.86 63.81 Favored Pre-proline 0 CA--C 1.541 0.623 0 O-C-N 120.866 -1.146 . . . . 0.0 111.918 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -63.25 146.36 93.81 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.997 2.465 . . . . 0.0 110.691 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -52.2 -20.38 2.58 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.32 -35.76 30.58 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.867 1.667 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.01 -26.47 31.2 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 176.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -44.84 110.65 0.24 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.243 1.017 . . . . 0.0 111.429 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -95.72 175.15 6.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.475 1.131 . . . . 0.0 110.221 -178.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.1 p -127.13 29.23 5.63 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.361 1.064 . . . . 0.0 112.429 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.523 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 9.5 m-85 -71.5 -15.94 62.33 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 121.409 -0.807 . . . . 0.0 111.207 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.14 82.8 0.07 OUTLIER Glycine 0 CA--C 1.53 0.978 0 CA-C-O 124.395 2.108 . . . . 0.0 112.095 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 174.25 32.71 0.03 OUTLIER Glycine 0 C--O 1.227 -0.327 0 O-C-N 120.627 -1.514 . . . . 0.0 113.339 -176.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 19.3 m -131.45 165.98 22.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 122.408 0.283 . . . . 0.0 111.742 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.7 p -54.0 -46.61 71.81 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 124.666 1.229 . . . . 0.0 112.251 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 1.4 t -132.15 -54.84 0.98 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.577 1.151 . . . . 0.0 111.424 -178.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 p -149.82 140.77 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 122.296 1.046 . . . . 0.0 110.605 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 76.6 m -83.2 138.93 33.42 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.904 -1.123 . . . . 0.0 109.98 171.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.1 140.98 48.84 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 122.855 1.312 . . . . 0.0 111.056 173.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -76.29 106.84 8.14 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 124.123 1.916 . . . . 0.0 112.889 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.5 mt -67.06 -36.19 81.49 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 119.284 -2.135 . . . . 0.0 110.908 -178.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.5 p -67.79 -22.75 65.17 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -35.06 11.01 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 124.054 0.942 . . . . 0.0 110.652 -179.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 48.3 mt -66.33 -62.23 1.58 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.928 0.891 . . . . 0.0 111.027 176.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -154.38 141.09 19.02 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.339 0.59 . . . . 0.0 112.379 -178.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.41 -28.78 67.82 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-O 118.432 -1.204 . . . . 0.0 113.265 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 34.8 t -47.02 -57.91 4.54 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 125.026 1.33 . . . . 0.0 109.618 -176.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -83.57 -29.93 27.42 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.297 0.639 . . . . 0.0 112.654 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.08 -38.32 65.92 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.604 0.621 . . . . 0.0 113.935 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -89.62 16.1 8.4 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.494 1.518 . . . . 0.0 112.882 176.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.69 34.37 87.22 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.147 0.403 . . . . 0.0 112.732 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.94 174.96 32.24 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-O 122.569 1.094 . . . . 0.0 112.111 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.93 136.27 28.41 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 122.424 1.107 . . . . 0.0 112.136 -177.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.5 t -73.53 123.45 23.96 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.899 -1.126 . . . . 0.0 112.488 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -127.28 147.09 60.56 Favored Pre-proline 0 CA--C 1.538 0.501 0 O-C-N 120.639 -1.288 . . . . 0.0 111.088 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -67.25 153.93 75.72 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.33 2.02 . . . . 0.0 110.565 176.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.406 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 13.7 mt -61.18 -18.46 58.31 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.0 -14.99 57.43 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.72 1.208 . . . . 0.0 112.258 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -88.93 139.8 30.09 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.705 -1.247 . . . . 0.0 110.009 175.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -96.7 122.33 39.52 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.841 0.856 . . . . 0.0 110.808 174.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.4 p -167.67 169.81 11.52 Favored 'General case' 0 C--O 1.214 -0.813 0 C-N-CA 123.224 0.61 . . . . 0.0 110.575 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -74.06 111.19 8.98 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.937 -0.477 . . . . 0.0 110.575 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.36 136.07 53.8 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.97 1.308 . . . . 0.0 111.369 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.09 143.6 29.59 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 120.885 -1.134 . . . . 0.0 110.734 176.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.03 -41.87 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.736 0.814 . . . . 0.0 113.089 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.73 -36.15 67.7 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.74 -0.6 . . . . 0.0 111.432 176.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.72 -30.9 51.95 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 121.853 -0.529 . . . . 0.0 111.242 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.4 ' HB2' ' CE ' ' A' ' 69' ' ' LYS . 28.3 p -55.27 -31.34 61.5 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 124.552 1.141 . . . . 0.0 111.722 178.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.93 -34.76 65.92 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 118.058 -0.973 . . . . 0.0 112.813 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.4 t -46.53 -53.08 12.03 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.362 1.465 . . . . 0.0 111.886 177.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 2.2 m -87.21 -56.54 3.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.401 174.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 39.48 -147.03 0.19 Allowed Glycine 0 C--O 1.217 -0.947 0 C-N-CA 125.599 1.571 . . . . 0.0 112.094 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 77.8 mttt 47.42 46.37 17.25 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.052 1.426 . . . . 0.0 113.909 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.63 19.8 65.21 Favored Glycine 0 CA--C 1.534 1.245 0 N-CA-C 114.241 0.456 . . . . 0.0 114.241 -174.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -139.23 150.98 46.16 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.941 1.696 . . . . 0.0 110.23 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.406 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -121.2 157.89 29.25 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.402 1.081 . . . . 0.0 109.954 178.046 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 50.6 t -101.5 96.28 7.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.652 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 33.8 m -89.67 144.22 26.17 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.16 0.584 . . . . 0.0 111.455 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.7 p -114.44 142.47 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.099 0.96 . . . . 0.0 110.186 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -108.18 -62.71 1.41 Allowed 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 123.627 0.771 . . . . 0.0 112.601 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -110.67 161.12 16.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.469 1.108 . . . . 0.0 110.513 179.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 115.384 -2.246 . . . . 0.0 113.334 170.954 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 118.606 -0.711 . . . . 0.0 109.898 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -119.97 -27.06 5.44 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.736 0.647 . . . . 0.0 111.096 -175.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -48.8 -59.28 3.69 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.517 -0.739 . . . . 0.0 111.168 176.197 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.56 -29.01 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.8 t -70.29 -30.03 66.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.442 1.097 . . . . 0.0 111.714 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.2 mmtt -94.4 -10.12 33.52 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 175.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.58 30.69 10.28 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-O 118.486 -1.175 . . . . 0.0 113.172 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -91.29 169.58 10.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.814 1.307 . . . . 0.0 112.062 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -122.33 133.92 9.49 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.102 0.858 . . . . 0.0 111.507 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 68.1 m -81.23 134.85 35.68 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 121.911 -0.758 . . . . 0.0 111.487 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.6 mt -145.76 155.78 52.24 Favored Pre-proline 0 C--O 1.22 -0.463 0 O-C-N 124.066 0.854 . . . . 0.0 111.87 178.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.08 141.8 71.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 123.222 2.615 . . . . 0.0 110.852 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -54.11 -22.18 10.38 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.7 p -69.23 -46.17 68.01 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 125.409 1.483 . . . . 0.0 113.004 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.54 -37.42 56.7 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.991 0.916 . . . . 0.0 111.96 176.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.6 t -89.33 118.75 69.4 Favored Pre-proline 0 C--O 1.243 0.724 0 O-C-N 121.433 -0.792 . . . . 0.0 111.832 -178.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -63.23 150.58 88.2 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.711 2.274 . . . . 0.0 110.833 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -54.27 -20.49 7.18 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -82.81 -24.52 33.31 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.884 1.273 . . . . 0.0 113.815 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -97.26 -19.91 18.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.848 1.659 . . . . 0.0 112.059 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -53.78 118.85 4.28 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 121.063 -1.023 . . . . 0.0 110.558 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.3 mt -103.0 173.85 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.315 1.055 . . . . 0.0 110.519 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.1 p -127.15 28.5 5.74 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 0.0 112.176 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -69.63 -18.15 63.57 Favored 'General case' 0 C--O 1.207 -1.156 0 O-C-N 121.481 -0.762 . . . . 0.0 110.988 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.88 87.32 0.08 OUTLIER Glycine 0 CA--C 1.526 0.726 0 CA-C-O 124.174 1.986 . . . . 0.0 112.032 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.68 31.15 0.03 OUTLIER Glycine 0 C--O 1.221 -0.718 0 O-C-N 120.346 -1.679 . . . . 0.0 113.694 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.406 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 93.3 m -138.83 145.39 40.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.219 0.509 . . . . 0.0 110.488 176.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.3 t -60.81 -40.78 93.97 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 124.156 0.91 . . . . 0.0 111.447 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.7 p -108.65 -73.62 0.68 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.727 1.211 . . . . 0.0 111.066 -177.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.9 p -150.76 148.36 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.864 1.266 . . . . 0.0 110.74 175.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.406 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 m -76.72 136.56 39.07 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 120.948 -1.095 . . . . 0.0 109.964 171.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.45 133.2 55.45 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 125.067 1.347 . . . . 0.0 112.114 175.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.5 ' OD2' ' HE2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -77.29 100.19 5.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 122.915 1.341 . . . . 0.0 113.46 178.547 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mt -59.35 -35.3 73.6 Favored 'General case' 0 C--O 1.22 -0.477 0 O-C-N 120.606 -1.309 . . . . 0.0 111.439 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.2 t -56.63 -39.7 74.12 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.933 0.893 . . . . 0.0 112.622 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HE2' ' OD2' ' A' ' 33' ' ' ASP . 27.2 mtmt -83.42 -35.33 25.11 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 123.288 0.635 . . . . 0.0 112.634 176.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.9 mp -63.7 -59.58 4.4 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.283 1.033 . . . . 0.0 110.22 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -167.84 143.65 3.93 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 122.469 1.128 . . . . 0.0 113.171 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -72.37 -12.54 76.84 Favored Glycine 0 CA--C 1.525 0.715 0 CA-C-O 117.218 -1.879 . . . . 0.0 113.629 175.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 17.0 t -44.71 -48.55 10.71 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 120.715 2.257 . . . . 0.0 113.428 -175.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -83.42 -42.38 17.03 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.5 172.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -52.28 -30.11 31.58 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-N 118.809 0.731 . . . . 0.0 114.227 178.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -78.46 10.75 2.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.051 1.74 . . . . 0.0 113.45 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.31 35.12 77.09 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.503 1.049 . . . . 0.0 112.624 -175.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -104.64 -176.61 24.92 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-O 122.554 1.085 . . . . 0.0 113.309 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -146.62 150.19 34.98 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 123.167 1.46 . . . . 0.0 111.979 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 85.0 m -73.17 118.25 15.9 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.692 -1.255 . . . . 0.0 111.581 174.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -116.26 146.86 38.23 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.908 0.883 . . . . 0.0 111.011 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.81 153.19 76.32 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.693 2.262 . . . . 0.0 110.665 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.9 mt -59.75 -25.07 64.56 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -72.43 -21.16 61.29 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.608 1.163 . . . . 0.0 112.796 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -92.58 130.66 38.16 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.006 -1.059 . . . . 0.0 110.705 176.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.26 133.04 44.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.946 174.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.493 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 0.6 OUTLIER -168.7 178.45 4.66 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.025 0.53 . . . . 0.0 110.288 174.453 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttt -102.75 105.86 16.37 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 123.755 0.822 . . . . 0.0 110.618 175.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -122.14 137.81 54.69 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.285 1.034 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.56 136.5 36.27 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -48.67 -37.62 19.0 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -78.39 -29.29 47.2 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.788 0.835 . . . . 0.0 112.248 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -81.61 -30.23 32.96 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.503 0.721 . . . . 0.0 111.221 177.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.6 t -57.2 -29.61 63.85 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.427 1.491 . . . . 0.0 111.385 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.7 -33.72 66.73 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.334 1.054 . . . . 0.0 113.387 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.8 t -52.29 -61.03 2.53 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.149 0.979 . . . . 0.0 111.833 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.1 m -75.85 -52.43 10.38 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 37.8 -146.31 0.12 Allowed Glycine 0 C--N 1.344 1.016 0 C-N-CA 126.73 2.109 . . . . 0.0 111.455 -176.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mttp 45.81 43.91 10.35 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 119.944 1.872 . . . . 0.0 114.029 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.73 17.71 74.64 Favored Glycine 0 CA--C 1.539 1.566 0 O-C-N 121.544 -0.722 . . . . 0.0 114.899 -175.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -130.31 150.64 51.45 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.878 2.071 . . . . 0.0 109.612 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -115.78 158.81 22.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.584 1.554 . . . . 0.0 110.365 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 39.9 t -108.08 92.66 4.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.001 0.52 . . . . 0.0 111.041 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 48.7 t -81.96 163.84 21.89 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.774 0.321 . . . . 0.0 111.661 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 p -123.14 144.29 33.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.012 1.325 . . . . 0.0 111.693 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.493 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 46.1 m95 -111.86 -177.81 3.27 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.507 1.123 . . . . 0.0 111.859 173.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.4 pp -124.12 30.16 6.19 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.671 1.588 . . . . 0.0 112.947 179.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 7.0 t60 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 116.176 -1.869 . . . . 0.0 111.766 -178.138 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -99.52 -29.94 12.44 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.53 -0.731 . . . . 0.0 110.89 -170.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.476 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 66.8 m -53.69 -54.49 37.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.712 1.205 . . . . 0.0 110.757 175.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -55.83 -38.07 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.052 1.341 . . . . 0.0 113.456 175.414 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.9 m -66.65 -23.66 66.18 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.303 1.041 . . . . 0.0 112.462 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 mmmm -97.03 -3.87 40.69 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 170.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.53 43.1 20.35 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.724 0.678 . . . . 0.0 112.319 -176.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -105.63 159.21 16.14 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.54 1.17 . . . . 0.0 112.836 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -108.84 131.05 10.35 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.405 1.002 . . . . 0.0 111.796 -178.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.97 130.98 44.32 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.462 0.705 . . . . 0.0 111.86 172.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.1 mt -139.6 162.21 52.46 Favored Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 123.376 0.422 . . . . 0.0 110.782 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.07 138.95 45.25 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.48 2.12 . . . . 0.0 111.509 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -53.38 -14.91 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 174.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.27 -48.68 19.32 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.735 2.014 . . . . 0.0 112.218 170.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -76.04 -33.64 59.63 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.576 1.151 . . . . 0.0 112.071 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 29.8 t -86.67 115.32 61.91 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 120.917 -1.115 . . . . 0.0 111.406 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -62.68 152.35 78.64 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.17 1.914 . . . . 0.0 110.914 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -57.64 -19.39 26.17 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.901 0.88 . . . . 0.0 113.093 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -81.5 -25.82 35.67 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.498 1.919 . . . . 0.0 114.531 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -101.38 -15.17 17.3 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.912 1.685 . . . . 0.0 112.707 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -53.72 106.29 0.18 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.958 1.303 . . . . 0.0 111.874 172.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.0 mt -89.71 165.54 14.14 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 122.252 1.025 . . . . 0.0 111.738 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 t -116.78 21.4 13.39 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.404 1.482 . . . . 0.0 111.936 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.476 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 43.1 m-85 -63.27 -18.59 63.74 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 174.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.24 66.46 2.65 Favored Glycine 0 N--CA 1.474 1.224 0 CA-C-N 120.567 1.531 . . . . 0.0 113.713 176.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.02 31.87 0.29 Allowed Glycine 0 N--CA 1.462 0.428 0 O-C-N 120.905 -1.35 . . . . 0.0 114.038 -175.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 49.0 m -137.83 164.54 28.67 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.057 0.943 . . . . 0.0 112.955 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 t -61.22 -31.28 71.06 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.1 t -139.98 -58.17 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.066 1.346 . . . . 0.0 111.716 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.5 p -147.3 155.23 11.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 122.088 0.947 . . . . 0.0 110.755 174.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 74.0 m -95.53 141.42 29.08 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 172.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -122.03 137.24 54.88 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.248 1.019 . . . . 0.0 111.787 177.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.23 103.86 4.8 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 122.082 0.944 . . . . 0.0 110.96 -178.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.5 mt -57.42 -43.34 83.74 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.967 -1.083 . . . . 0.0 111.749 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t -64.82 -33.35 75.8 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.467 1.107 . . . . 0.0 113.743 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -79.53 -37.4 36.64 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.882 0.873 . . . . 0.0 112.773 176.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.2 mt -64.68 -60.03 3.58 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 124.198 0.936 . . . . 0.0 110.814 177.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.7 t -173.83 145.63 1.16 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.373 0.669 . . . . 0.0 112.682 -177.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -52.93 -31.19 38.99 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 118.339 -1.256 . . . . 0.0 114.381 176.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.4 t -49.49 -51.76 33.9 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.568 1.684 . . . . 0.0 112.693 175.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -84.27 -36.75 22.43 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 122.982 0.513 . . . . 0.0 112.143 177.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.4 -36.8 64.1 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.083 0.849 . . . . 0.0 114.201 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -78.33 11.27 2.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.91 1.684 . . . . 0.0 113.448 172.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.39 18.59 63.4 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.239 1.876 . . . . 0.0 114.34 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.76 170.4 54.96 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 124.328 0.966 . . . . 0.0 112.742 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -137.96 142.61 40.5 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 122.733 1.254 . . . . 0.0 111.302 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.1 t -68.21 127.17 31.93 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.461 -0.774 . . . . 0.0 111.54 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -124.47 150.47 64.68 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 123.332 0.653 . . . . 0.0 111.887 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -71.12 157.44 57.55 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.384 2.056 . . . . 0.0 111.924 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -59.83 -27.35 66.56 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.45 -17.82 62.35 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.216 2.606 . . . . 0.0 113.08 176.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -88.14 129.17 35.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.944 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.88 121.36 21.74 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.272 0.629 . . . . 0.0 110.834 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -160.58 -176.93 5.86 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.989 1.316 . . . . 0.0 109.695 167.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.8 tppt? -92.71 126.08 37.63 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.904 1.282 . . . . 0.0 109.312 166.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.468 ' CD ' ' HE3' ' A' ' 69' ' ' LYS . 2.1 pm0 -124.9 146.98 49.07 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.325 1.45 . . . . 0.0 110.335 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -94.93 148.89 21.83 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.594 -0.691 . . . . 0.0 110.69 175.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -58.97 -42.56 90.2 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.0 0.92 . . . . 0.0 112.699 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.52 -30.09 57.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.3 1.04 . . . . 0.0 111.908 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.22 -37.44 20.09 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.053 0.941 . . . . 0.0 111.852 -178.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -58.07 -33.37 68.99 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.155 -1.591 . . . . 0.0 112.212 172.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.38 -41.69 72.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.54 0.736 . . . . 0.0 112.346 172.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.8 p -80.79 -19.65 44.3 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -63.82 -25.24 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.052 0.842 . . . . 0.0 111.619 174.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.11 163.12 16.72 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 122.419 1.011 . . . . 0.0 112.083 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.2 mttm -61.3 123.44 17.75 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.444 -1.033 . . . . 0.0 110.416 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.05 22.89 60.25 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.664 -1.076 . . . . 0.0 113.518 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -135.59 165.65 25.06 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.267 1.827 . . . . 0.0 111.452 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HE3' ' CD ' ' A' ' 56' ' ' GLU . 54.6 mtpt -138.76 115.47 10.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.426 1.89 . . . . 0.0 111.941 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.3 t -73.39 104.94 4.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.91 -0.494 . . . . 0.0 110.921 -176.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.96 158.61 16.63 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.102 0.961 . . . . 0.0 110.994 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.7 m -132.48 145.41 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.712 1.605 . . . . 0.0 110.956 177.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -117.34 -71.81 0.72 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.736 1.214 . . . . 0.0 112.827 -176.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.6 166.57 6.66 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.494 1.518 . . . . 0.0 112.094 169.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.2 p80 . . . . . 0 C--O 1.245 0.849 0 C-N-CA 127.164 2.186 . . . . 0.0 116.639 -179.917 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . 0.448 ' HA ' ' O ' ' A' ' 25' ' ' GLY . 2.9 p-10 . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -123.59 -19.48 5.82 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.982 0.913 . . . . 0.0 112.625 -176.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.1 m -54.42 -63.92 1.0 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.016 -1.052 . . . . 0.0 111.056 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.427 HG13 HD21 ' A' ' 1' ' ' ASN . 5.1 p -56.3 -35.2 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.447 0.699 . . . . 0.0 112.703 177.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.4 m -60.65 -29.48 69.29 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.64 1.176 . . . . 0.0 112.002 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -97.15 -8.94 28.91 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 172.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.7 32.4 30.32 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.836 -0.98 . . . . 0.0 113.2 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -78.62 170.16 17.1 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.336 1.568 . . . . 0.0 112.549 174.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.82 116.12 3.91 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 125.321 1.439 . . . . 0.0 111.081 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.43 129.9 38.07 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.694 -0.886 . . . . 0.0 111.699 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.1 mt -143.13 159.08 57.14 Favored Pre-proline 0 C--O 1.22 -0.457 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.888 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.42 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 59.3 Cg_endo -68.55 144.97 62.73 Favored 'Trans proline' 0 C--O 1.217 -0.563 0 C-N-CA 123.407 2.738 . . . . 0.0 112.549 173.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -53.04 -18.97 2.36 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 177.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.0 t -72.55 -49.19 34.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.694 2.397 . . . . 0.0 111.77 169.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -76.79 -34.2 57.97 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.369 1.067 . . . . 0.0 110.59 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.0 t -95.21 115.34 65.33 Favored Pre-proline 0 C--O 1.242 0.686 0 O-C-N 120.608 -1.308 . . . . 0.0 111.633 -175.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -62.83 153.61 71.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.958 2.438 . . . . 0.0 110.746 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -53.44 -31.93 47.53 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.46 -18.13 61.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.834 1.254 . . . . 0.0 113.239 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.39 -23.45 15.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.32 1.448 . . . . 0.0 113.599 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -53.07 117.71 3.2 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.305 -0.872 . . . . 0.0 110.759 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.5 mt -103.35 172.2 6.95 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.375 1.084 . . . . 0.0 111.195 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -117.83 25.51 10.32 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.122 1.369 . . . . 0.0 112.336 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -70.66 -14.66 62.55 Favored 'General case' 0 C--O 1.211 -0.956 0 C-N-CA 123.528 0.731 . . . . 0.0 111.964 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 1' ' ' ASN . . . 53.33 85.19 0.02 OUTLIER Glycine 0 N--CA 1.469 0.858 0 CA-C-O 123.243 1.468 . . . . 0.0 113.627 175.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.16 29.51 0.02 OUTLIER Glycine 0 C--O 1.225 -0.458 0 O-C-N 120.604 -1.527 . . . . 0.0 114.202 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.7 m -129.7 158.71 38.62 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.475 1.11 . . . . 0.0 111.169 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.6 m -47.68 -48.57 29.09 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.399 1.08 . . . . 0.0 112.785 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.42 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -128.22 -59.03 1.19 Allowed 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.518 1.527 . . . . 0.0 110.961 179.62 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.06 145.14 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 122.886 1.327 . . . . 0.0 109.676 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 t -82.59 139.16 33.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.561 171.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.73 132.88 56.41 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.955 1.702 . . . . 0.0 110.781 174.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.16 103.49 4.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 123.28 1.514 . . . . 0.0 112.319 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.6 mt -55.06 -42.25 72.49 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.697 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 t -59.24 -38.76 80.82 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.529 1.532 . . . . 0.0 113.205 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -77.06 -37.09 55.35 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.231 -0.89 . . . . 0.0 112.077 175.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.67 -68.01 0.38 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.561 0.745 . . . . 0.0 110.021 176.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 30.8 p -151.17 168.78 23.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 122.858 1.313 . . . . 0.0 112.377 -175.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -83.23 -35.32 18.14 Favored Glycine 0 CA--C 1.525 0.707 0 O-C-N 119.373 -2.08 . . . . 0.0 112.819 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 46.3 t -51.08 -53.95 29.36 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 119.234 1.517 . . . . 0.0 111.006 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.8 -41.93 64.43 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.97 -36.66 74.71 Favored Glycine 0 CA--C 1.533 1.189 0 O-C-N 123.711 0.632 . . . . 0.0 113.247 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HZ2' ' CD ' ' A' ' 60' ' ' GLU . 26.3 mtmm -86.36 16.43 4.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.465 1.906 . . . . 0.0 114.137 175.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.12 47.69 79.23 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.46 1.028 . . . . 0.0 112.993 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -101.34 164.36 18.0 Favored Glycine 0 C--O 1.244 0.728 0 C-N-CA 124.799 1.19 . . . . 0.0 113.953 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -133.3 145.97 50.93 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.905 1.682 . . . . 0.0 110.625 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.9 m -73.28 121.04 19.73 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.088 -1.008 . . . . 0.0 111.113 175.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -120.23 150.01 50.63 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.998 0.919 . . . . 0.0 111.187 177.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -68.95 154.11 71.42 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.434 2.089 . . . . 0.0 110.553 176.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.7 mt -60.29 -20.83 60.74 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -70.54 -17.27 62.93 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.372 1.869 . . . . 0.0 111.952 173.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -92.94 132.35 37.13 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 120.667 -1.27 . . . . 0.0 110.44 177.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -90.05 119.29 30.28 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.627 0.771 . . . . 0.0 110.376 174.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -167.26 166.58 14.69 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.769 1.227 . . . . 0.0 110.241 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.3 tttt -71.48 112.11 7.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.477 1.111 . . . . 0.0 108.928 175.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.433 ' HG2' ' CE ' ' A' ' 69' ' ' LYS . 1.9 pp20? -120.15 142.85 48.58 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 124.003 0.921 . . . . 0.0 109.618 175.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -98.27 141.18 31.49 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.603 0.761 . . . . 0.0 111.191 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -62.21 -39.61 93.34 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.073 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.49 -32.34 58.27 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.707 0.765 . . . . 0.0 111.772 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.537 ' CD ' ' HZ2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -77.06 -35.56 56.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 179.373 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.9 t -52.18 -34.82 46.89 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.998 1.319 . . . . 0.0 112.359 174.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.97 63.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.242 1.017 . . . . 0.0 112.734 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 40.4 t -60.08 -54.98 39.51 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.037 1.735 . . . . 0.0 111.176 175.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 87.5 m -63.19 -43.17 98.97 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 117.88 176.85 17.2 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 122.716 1.175 . . . . 0.0 113.098 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -62.42 131.75 50.26 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.793 -0.828 . . . . 0.0 111.597 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.82 -2.87 82.68 Favored Glycine 0 CA--C 1.531 1.064 0 CA-C-O 118.345 -1.253 . . . . 0.0 113.942 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.2 164.12 16.72 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.396 1.878 . . . . 0.0 109.656 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.433 ' CE ' ' HG2' ' A' ' 56' ' ' GLU . 23.7 mtpt -133.55 125.09 28.1 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.239 1.816 . . . . 0.0 109.725 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 t -78.61 100.4 6.97 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 122.855 0.462 . . . . 0.0 111.035 176.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.47 136.66 38.27 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.648 0.737 . . . . 0.0 111.043 176.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.6 m -103.66 144.46 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.154 0.982 . . . . 0.0 111.21 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.8 m95 -104.91 -78.19 0.57 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.374 0.67 . . . . 0.0 111.326 179.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.9 mp -103.16 103.3 13.34 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.355 1.862 . . . . 0.0 107.662 178.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 60.0 t60 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 116.634 -1.65 . . . . 0.0 115.022 174.664 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.505 -0.773 0 CA-C-O 117.398 -1.287 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -118.43 -29.5 5.46 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 124.8 1.312 . . . . 0.0 109.877 -177.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.3 m -56.91 -57.55 12.02 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 121.175 -0.953 . . . . 0.0 110.638 178.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.26 -33.01 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.66 -0.65 . . . . 0.0 112.384 177.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -62.29 -31.13 71.68 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.329 0.652 . . . . 0.0 111.28 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -96.95 -10.44 26.32 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.24 45.5 4.08 Favored Glycine 0 C--O 1.222 -0.651 0 CA-C-O 118.423 -1.209 . . . . 0.0 111.324 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.506 ' CE2' ' CZ ' ' A' ' 24' ' ' TYR . 77.3 m-85 -108.27 163.25 13.35 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.121 0.96 . . . . 0.0 111.358 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 131.84 10.42 Favored Glycine 0 CA--C 1.523 0.536 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.781 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.8 m -80.43 118.99 22.54 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.048 177.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 30.6 mt -132.93 154.95 81.6 Favored Pre-proline 0 C--O 1.211 -0.944 0 O-C-N 124.171 0.92 . . . . 0.0 112.025 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.52 141.21 72.67 Favored 'Trans proline' 0 C--O 1.213 -0.769 0 C-N-CA 124.394 3.396 . . . . 0.0 110.395 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -49.79 -30.97 10.63 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.896 0.879 . . . . 0.0 112.594 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 t -65.85 -44.53 85.18 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.185 1.179 . . . . 0.0 114.185 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.5 -47.57 59.86 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.392 0.677 . . . . 0.0 112.363 174.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -86.0 128.74 56.84 Favored Pre-proline 0 CA--C 1.541 0.615 0 CA-C-O 121.422 0.629 . . . . 0.0 111.9 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -65.5 144.71 80.32 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.289 1.992 . . . . 0.0 110.958 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -51.85 -19.74 1.88 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 173.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -78.31 -36.11 46.92 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.779 0.832 . . . . 0.0 112.792 176.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.72 -28.31 26.4 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 116.026 -1.94 . . . . 0.0 110.776 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -44.14 119.82 1.92 Allowed 'General case' 0 C--N 1.345 0.396 0 O-C-N 125.105 1.503 . . . . 0.0 110.625 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 mt -103.18 178.4 4.57 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.2 p -121.35 30.26 6.86 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.157 0.983 . . . . 0.0 111.109 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.506 ' CZ ' ' CE2' ' A' ' 8' ' ' PHE . 62.7 m-85 -69.14 -19.18 64.02 Favored 'General case' 0 C--O 1.202 -1.409 0 CA-C-O 119.085 -0.483 . . . . 0.0 110.461 177.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.53 49.68 75.91 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 120.768 1.622 . . . . 0.0 111.804 178.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -143.23 36.67 1.56 Allowed Glycine 0 C--O 1.223 -0.592 0 CA-C-O 117.944 -1.476 . . . . 0.0 112.703 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 91.5 m -144.94 151.25 38.35 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 117.59 0.695 . . . . 0.0 111.4 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 p -63.22 -43.22 98.72 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 123.652 0.595 . . . . 0.0 111.558 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.1 p -105.93 -74.67 0.65 Allowed 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.001 0.52 . . . . 0.0 109.744 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.9 p -151.92 144.42 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 123.499 1.619 . . . . 0.0 111.336 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.8 t -80.34 128.24 33.33 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 120.594 -1.316 . . . . 0.0 111.059 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -106.43 138.27 42.92 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 124.049 0.843 . . . . 0.0 112.033 177.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -83.11 104.66 13.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.6 mt -65.26 -30.39 71.26 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 120.837 -1.164 . . . . 0.0 110.854 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 p -59.24 -36.67 75.88 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 120.484 -1.385 . . . . 0.0 112.634 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.4 mtmt -87.87 -35.53 17.7 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 123.54 0.525 . . . . 0.0 111.853 178.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -76.05 -71.98 0.35 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.233 0.613 . . . . 0.0 109.865 -178.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -171.63 163.49 6.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 122.604 1.192 . . . . 0.0 111.462 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -94.53 32.28 6.13 Favored Glycine 0 C--O 1.212 -1.269 0 CA-C-O 116.846 -2.086 . . . . 0.0 113.512 175.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 47.3 t -47.95 -58.1 4.86 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.271 2.036 . . . . 0.0 111.901 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp -88.58 -40.03 13.67 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.146 179.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.68 -31.67 45.74 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 122.994 0.331 . . . . 0.0 112.854 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -77.05 14.53 0.85 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.69 32.87 85.64 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 123.958 0.789 . . . . 0.0 112.091 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.74 179.2 30.21 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 122.091 0.828 . . . . 0.0 113.168 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -146.8 153.67 40.46 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 123.218 1.485 . . . . 0.0 111.719 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.1 m -67.48 131.68 46.15 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.702 -1.249 . . . . 0.0 113.196 172.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -130.44 148.87 71.66 Favored Pre-proline 0 N--CA 1.452 -0.366 0 CA-C-O 121.65 0.738 . . . . 0.0 111.594 178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.86 152.28 77.45 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.584 2.189 . . . . 0.0 111.405 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.415 ' CD2' ' HG3' ' A' ' 69' ' ' LYS . 12.9 mt -63.49 -18.96 64.34 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 176.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -81.34 -12.7 58.94 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.724 0.81 . . . . 0.0 111.399 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -94.19 136.09 34.86 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 120.965 -1.085 . . . . 0.0 110.444 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -86.19 123.2 31.21 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.986 176.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -169.74 -176.86 2.5 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.48 0.712 . . . . 0.0 111.156 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -97.4 109.02 21.86 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.611 0.764 . . . . 0.0 112.837 174.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -113.05 137.51 51.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.133 0.968 . . . . 0.0 110.987 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.404 ' CD1' ' H ' ' A' ' 59' ' ' ALA . 0.3 OUTLIER -83.28 145.34 29.15 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.53 176.237 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -66.75 -42.59 85.95 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.594 0.711 . . . . 0.0 112.776 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.404 ' H ' ' CD1' ' A' ' 57' ' ' LEU . . . -73.48 -32.53 64.35 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.474 -0.766 . . . . 0.0 111.869 177.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -78.22 -39.5 40.27 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.409 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.5 p -53.18 -32.62 48.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 124.721 1.209 . . . . 0.0 112.0 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.22 -30.28 64.44 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.1 p -61.36 -51.45 68.77 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 123.39 0.676 . . . . 0.0 111.665 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.4 t -66.23 -33.91 76.82 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.55 0.34 . . . . 0.0 110.117 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -178.92 27.99 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 123.291 1.495 . . . . 0.0 112.155 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -64.14 154.01 35.98 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.208 -1.172 . . . . 0.0 111.361 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.21 8.84 71.09 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.745 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -143.06 157.24 44.71 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.048 0.939 . . . . 0.0 110.604 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.415 ' HG3' ' CD2' ' A' ' 50' ' ' LEU . 5.6 mtmp? -128.53 120.65 27.17 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.384 0.674 . . . . 0.0 111.001 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.3 t -80.15 102.09 9.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.212 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.19 168.26 14.14 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 175.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.0 p -128.43 144.44 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 C-N-CA 123.763 0.825 . . . . 0.0 111.237 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 23.8 m95 -121.04 177.06 5.27 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.89 0.852 . . . . 0.0 111.786 175.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.1 mp -112.8 -4.01 14.09 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.113 178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.6 m170 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 115.583 -2.151 . . . . 0.0 111.214 179.714 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 120.949 0.404 . . . . 0.0 110.02 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -103.48 -37.63 7.5 Favored 'General case' 0 C--O 1.212 -0.883 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -46.26 -56.04 6.32 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 121.411 -0.806 . . . . 0.0 110.99 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.9 -23.88 21.97 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.634 0 CA-C-O 121.054 0.454 . . . . 0.0 111.681 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 t -64.66 -35.13 80.04 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 121.516 0.674 . . . . 0.0 111.203 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.472 ' HD3' ' CD2' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -97.23 -13.75 21.83 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.811 -0.556 . . . . 0.0 111.602 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.2 29.84 7.33 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 119.018 -0.879 . . . . 0.0 112.621 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.417 ' CD2' ' HB2' ' A' ' 6' ' ' LYS . 57.4 m-85 -85.38 173.89 9.96 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.374 0.587 . . . . 0.0 111.389 179.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.2 131.71 7.3 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.644 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.8 m -83.73 132.18 34.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 122.608 -0.348 . . . . 0.0 111.134 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.0 mt -151.24 154.66 34.11 Favored Pre-proline 0 C--O 1.199 -1.555 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.27 137.54 40.47 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.84 3.027 . . . . 0.0 111.626 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.441 ' CG ' HG12 ' A' ' 30' ' ' VAL . 87.2 mt-30 -46.82 -31.27 2.93 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 123.111 0.564 . . . . 0.0 110.437 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.7 t -57.78 -43.95 85.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 121.782 -0.574 . . . . 0.0 112.368 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -86.4 -33.66 20.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.548 0.69 . . . . 0.0 112.117 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.5 t -90.63 125.22 60.2 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-O 121.498 0.666 . . . . 0.0 111.345 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.47 148.93 74.13 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.024 2.482 . . . . 0.0 111.712 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -14.59 6.15 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.054 0.541 . . . . 0.0 111.844 177.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -85.82 -23.71 27.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.84 0.456 . . . . 0.0 112.116 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -98.2 -25.41 14.9 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 122.74 0.416 . . . . 0.0 111.114 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.0 mtt180 -46.9 123.44 5.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.344 0.658 . . . . 0.0 110.3 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.0 mt -107.99 177.07 4.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.343 0.592 . . . . 0.0 110.406 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.8 m -133.04 36.36 3.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.816 0.817 . . . . 0.0 111.341 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.472 ' CD2' ' HD3' ' A' ' 6' ' ' LYS . 11.3 m-85 -71.54 -18.35 62.27 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 121.716 -0.615 . . . . 0.0 110.74 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.9 82.79 0.12 Allowed Glycine 0 C--O 1.22 -0.731 0 CA-C-O 122.83 1.239 . . . . 0.0 111.728 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 178.87 26.46 0.04 OUTLIER Glycine 0 C--O 1.22 -0.726 0 O-C-N 120.545 -1.562 . . . . 0.0 113.245 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 86.5 m -129.75 149.97 51.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.595 0.358 . . . . 0.0 111.477 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.4 p -63.97 -39.83 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.189 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.9 p -112.39 -75.22 0.61 Allowed 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 121.358 0.599 . . . . 0.0 110.627 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.441 HG12 ' CG ' ' A' ' 13' ' ' GLN . 7.1 p -152.99 134.11 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-O 123.387 1.565 . . . . 0.0 111.057 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 m -69.83 138.05 52.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 120.124 -1.61 . . . . 0.0 111.513 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -114.12 148.77 36.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.151 0.501 . . . . 0.0 111.084 178.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -92.25 106.33 18.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.163 0.506 . . . . 0.0 110.848 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 mt -66.87 -35.0 79.03 Favored 'General case' 0 C--O 1.219 -0.548 0 O-C-N 121.849 -0.532 . . . . 0.0 110.879 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t -62.66 -38.71 91.38 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 122.58 0.352 . . . . 0.0 111.542 178.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -80.15 -36.23 35.43 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 122.762 0.425 . . . . 0.0 110.879 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.7 mt -66.4 -58.81 4.49 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.304 0.574 . . . . 0.0 110.491 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 60.3 p -137.67 -176.3 4.37 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 122.394 1.093 . . . . 0.0 111.232 -179.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -119.96 2.17 13.25 Favored Glycine 0 C--O 1.225 -0.456 0 O-C-N 121.036 -1.04 . . . . 0.0 113.0 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -58.28 -51.79 68.31 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.535 0.683 . . . . 0.0 109.276 -176.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -38.27 79.59 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.79 179.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.82 -42.79 92.12 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -79.58 9.43 4.98 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.675 0.39 . . . . 0.0 111.658 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.17 38.85 24.91 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 112.337 -0.305 . . . . 0.0 112.337 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.94 173.37 19.09 Favored Glycine 0 N--CA 1.451 -0.35 0 O-C-N 122.591 -0.359 . . . . 0.0 112.506 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -151.71 157.32 41.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.158 0.98 . . . . 0.0 111.639 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 t -71.95 133.39 45.34 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 121.409 -0.807 . . . . 0.0 111.612 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -133.84 147.74 65.5 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 122.021 0.915 . . . . 0.0 111.65 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.28 156.19 66.6 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.943 2.429 . . . . 0.0 112.111 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.431 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 18.3 mt -60.25 -16.44 33.81 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.609 178.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -80.69 -14.38 58.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.425 0.631 . . . . 0.0 111.49 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -90.93 147.37 23.17 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 121.378 -0.826 . . . . 0.0 110.746 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -106.68 122.07 45.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.357 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -174.74 164.87 3.64 Favored 'General case' 0 C--O 1.2 -1.525 0 C-N-CA 122.739 0.415 . . . . 0.0 111.877 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm -75.25 113.4 12.57 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.637 -0.664 . . . . 0.0 110.296 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.21 132.57 46.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 122.188 0.994 . . . . 0.0 110.842 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 tp -80.96 132.29 35.39 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.084 -1.01 . . . . 0.0 110.588 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -55.88 -39.3 71.34 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 122.154 -0.341 . . . . 0.0 111.575 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.77 70.21 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.691 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -78.68 -36.72 43.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 122.411 0.285 . . . . 0.0 111.51 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 18.6 m -51.96 -37.79 54.24 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 123.411 0.684 . . . . 0.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.27 -28.36 58.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.9 m -56.93 -58.27 8.9 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.237 0.615 . . . . 0.0 110.805 179.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.3 m -60.16 -37.97 81.76 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.137 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 119.31 -156.41 15.75 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-O 122.173 0.874 . . . . 0.0 111.871 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.5 pttt -89.25 133.14 34.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 O-C-N 121.614 -0.933 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 13.74 60.38 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 121.188 -0.529 . . . . 0.0 113.032 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -144.56 150.0 36.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.865 0.466 . . . . 0.0 111.034 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.431 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 16.5 mmtp -127.95 122.03 31.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.434 0.635 . . . . 0.0 111.456 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -78.47 110.51 13.61 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.822 -0.549 . . . . 0.0 111.431 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 95.6 m -99.46 162.61 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.509 0.671 . . . . 0.0 111.509 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.1 p -119.18 144.55 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.816 -0.553 . . . . 0.0 110.971 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 29.6 m95 -127.09 178.94 5.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.544 0.688 . . . . 0.0 111.056 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -134.38 162.71 31.45 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.42 0.688 . . . . 0.0 111.177 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 C--O 1.246 0.874 0 CA-C-O 117.47 -1.252 . . . . 0.0 112.139 177.843 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . 0.431 HD21 ' N ' ' A' ' 2' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.217 -0.634 0 CA-C-O 118.359 -0.829 . . . . 0.0 108.836 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.431 ' N ' HD21 ' A' ' 1' ' ' ASN . 23.8 mm-40 -122.18 -34.75 3.26 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 124.27 0.981 . . . . 0.0 110.475 -177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.424 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -50.9 -48.05 60.6 Favored 'General case' 0 C--N 1.342 0.25 0 O-C-N 121.644 -0.66 . . . . 0.0 111.853 177.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.6 p -57.17 -29.96 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 t -71.17 -29.59 65.38 Favored 'General case' 0 C--O 1.23 0.043 0 C-N-CA 124.252 1.021 . . . . 0.0 111.247 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.464 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -94.02 -11.81 29.98 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 174.452 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.98 45.76 4.7 Favored Glycine 0 C--O 1.224 -0.504 0 O-C-N 124.339 1.025 . . . . 0.0 111.693 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.455 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 54.0 m-85 -111.21 163.75 13.59 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.401 1.101 . . . . 0.0 111.369 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.94 136.08 12.66 Favored Glycine 0 CA--C 1.522 0.504 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 83.3 m -80.56 125.36 29.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.621 176.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 48.7 mt -137.7 155.94 74.84 Favored Pre-proline 0 C--O 1.214 -0.799 0 O-C-N 124.01 0.819 . . . . 0.0 112.078 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.1 140.81 67.05 Favored 'Trans proline' 0 C--O 1.214 -0.697 0 C-N-CA 124.254 3.303 . . . . 0.0 110.255 178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -49.5 -31.0 9.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.959 0.903 . . . . 0.0 112.745 176.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.0 t -66.13 -44.92 82.84 Favored 'General case' 0 C--O 1.224 -0.289 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -72.41 -44.97 61.71 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.571 0.748 . . . . 0.0 112.475 175.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 13.9 t -89.51 124.68 63.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 121.444 -0.785 . . . . 0.0 112.278 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -64.01 149.27 90.87 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.694 2.263 . . . . 0.0 111.206 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -54.2 -18.15 3.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -79.34 -32.66 43.35 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.968 0.907 . . . . 0.0 113.198 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.02 -23.2 21.55 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.686 177.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -45.48 116.49 1.17 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.938 0.895 . . . . 0.0 110.701 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.1 mt -95.52 177.27 5.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 122.339 1.066 . . . . 0.0 109.267 -178.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.1 m -130.4 28.68 4.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.192 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.464 ' CE1' ' HG3' ' A' ' 6' ' ' LYS . 37.7 m-85 -70.4 -19.36 63.01 Favored 'General case' 0 C--O 1.211 -0.936 0 O-C-N 121.891 -0.505 . . . . 0.0 111.525 177.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.89 78.87 0.26 Allowed Glycine 0 CA--C 1.527 0.839 0 CA-C-O 124.19 1.995 . . . . 0.0 111.555 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.29 27.88 0.09 OUTLIER Glycine 0 C--O 1.218 -0.86 0 O-C-N 118.968 -2.489 . . . . 0.0 112.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 84.5 m -135.62 143.48 45.58 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 117.863 0.831 . . . . 0.0 111.125 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.8 m -61.6 -33.99 74.86 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.519 1.137 . . . . 0.0 111.531 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 54.3 p -113.23 -76.0 0.59 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 123.184 0.593 . . . . 0.0 111.011 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.6 p -151.69 145.19 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 123.255 1.502 . . . . 0.0 111.261 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 1.9 m -81.17 137.04 35.93 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 120.07 -1.644 . . . . 0.0 110.303 175.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.07 141.08 46.18 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.654 0.782 . . . . 0.0 112.165 176.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.7 t0 -83.57 104.61 13.84 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.904 0.859 . . . . 0.0 110.434 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.7 mt -66.08 -32.61 74.17 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 121.432 -0.792 . . . . 0.0 110.992 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.1 m -66.05 -33.83 76.69 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 119.544 -1.973 . . . . 0.0 112.45 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -80.97 -35.62 31.88 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.075 0.55 . . . . 0.0 112.208 177.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.0 mp -89.31 -68.56 0.77 Allowed 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 121.392 0.615 . . . . 0.0 109.389 -178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.1 t -172.11 147.1 2.02 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 122.811 1.291 . . . . 0.0 112.992 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -104.91 31.3 8.73 Favored Glycine 0 C--O 1.212 -1.239 0 CA-C-O 117.986 -1.452 . . . . 0.0 112.405 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 53.9 t -52.36 -54.5 30.99 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 120.402 2.101 . . . . 0.0 111.535 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.15 -37.6 20.0 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 123.747 0.819 . . . . 0.0 112.087 177.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -62.48 -37.88 95.41 Favored Glycine 0 C--O 1.219 -0.808 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -177.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -78.87 15.93 0.99 Allowed 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.971 0.908 . . . . 0.0 112.508 174.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 65.89 30.54 77.33 Favored Glycine 0 CA--C 1.529 0.932 0 O-C-N 121.386 -0.821 . . . . 0.0 112.078 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.62 166.4 54.14 Favored Glycine 0 CA--C 1.524 0.653 0 O-C-N 122.033 -0.687 . . . . 0.0 112.388 177.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -144.44 154.73 43.25 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.656 1.217 . . . . 0.0 111.206 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.4 109.09 4.01 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.573 -0.704 . . . . 0.0 112.491 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -106.81 148.7 37.38 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 121.805 0.812 . . . . 0.0 111.993 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -67.14 153.54 77.21 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.55 2.167 . . . . 0.0 110.99 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.5 mt -60.21 -16.45 33.5 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 174.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -78.25 -18.21 55.65 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.098 0.959 . . . . 0.0 112.258 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -87.38 145.65 26.22 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.455 -1.403 . . . . 0.0 110.822 176.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -98.95 121.96 41.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.886 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -174.17 161.27 3.52 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 123.832 0.853 . . . . 0.0 111.202 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.19 110.52 6.7 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 122.702 0.401 . . . . 0.0 110.748 177.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.421 ' OE1' ' HB3' ' A' ' 61' ' ' SER . 0.8 OUTLIER -125.11 133.57 52.81 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.619 1.199 . . . . 0.0 110.112 178.191 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.1 tp -82.48 129.21 34.86 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 171.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -51.67 -40.01 59.28 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.441 -0.787 . . . . 0.0 113.002 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.45 -24.75 67.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.273 1.029 . . . . 0.0 111.998 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -91.17 -42.5 10.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.662 1.185 . . . . 0.0 113.489 176.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.421 ' HB3' ' OE1' ' A' ' 56' ' ' GLU . 24.8 p -52.24 -26.68 12.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.739 0.699 . . . . 0.0 112.82 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.27 85.16 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 175.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.5 t -67.33 -50.26 60.77 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.186 0.994 . . . . 0.0 111.635 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 10.8 m -51.71 -38.32 54.65 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.667 0.387 . . . . 0.0 112.043 178.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 121.08 156.36 9.78 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.808 1.227 . . . . 0.0 111.036 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -51.68 129.97 27.3 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.168 -1.195 . . . . 0.0 110.992 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.71 12.14 64.79 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -135.63 157.21 47.43 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 124.101 0.961 . . . . 0.0 110.445 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -135.17 120.58 19.14 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 124.834 1.253 . . . . 0.0 110.34 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.78 98.84 0.56 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.447 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 65.8 m -97.31 159.85 14.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.738 1.256 . . . . 0.0 111.351 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -111.97 145.29 18.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 O-C-N 121.522 -0.736 . . . . 0.0 110.92 177.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.9 m95 -129.24 -3.17 5.0 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 117.609 -1.186 . . . . 0.0 113.889 178.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -24.79 121.25 0.05 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.826 1.65 . . . . 0.0 112.337 173.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 116.363 -1.78 . . . . 0.0 111.175 179.792 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' GLY . 0.6 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -124.16 -24.85 4.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.559 0.744 . . . . 0.0 112.73 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.496 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 68.3 m -51.32 -60.16 3.43 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.732 1.213 . . . . 0.0 110.102 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -57.54 -33.71 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 175.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t -64.79 -26.87 68.53 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.983 1.313 . . . . 0.0 111.793 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 -10.65 23.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.505 174.078 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.15 30.83 21.64 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 124.32 0.962 . . . . 0.0 113.666 -177.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -82.39 165.32 20.39 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.249 1.024 . . . . 0.0 112.776 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.2 123.2 6.59 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.609 1.1 . . . . 0.0 111.721 178.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -72.85 131.53 42.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.636 -0.92 . . . . 0.0 111.878 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.5 mt -140.99 161.84 51.54 Favored Pre-proline 0 CA--C 1.535 0.369 0 O-C-N 124.007 0.817 . . . . 0.0 111.107 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.98 142.27 50.9 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.364 2.043 . . . . 0.0 111.067 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.45 -20.39 7.47 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -70.24 -46.81 63.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.049 1.34 . . . . 0.0 112.525 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.29 -39.08 49.25 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.334 1.053 . . . . 0.0 111.076 176.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.8 t -86.68 110.92 36.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 O-C-N 120.481 -1.387 . . . . 0.0 112.024 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -61.24 150.29 85.34 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.911 2.407 . . . . 0.0 110.434 -178.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -49.97 -23.68 2.15 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 176.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -72.46 -42.49 64.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.465 1.906 . . . . 0.0 111.818 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.26 -20.6 31.92 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.337 -1.316 . . . . 0.0 113.049 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -52.14 106.39 0.15 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.282 1.401 . . . . 0.0 111.802 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.0 mt -90.19 172.7 8.61 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.826 0.822 . . . . 0.0 111.259 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 m -123.72 27.36 7.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 112.786 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.496 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 11.8 m-85 -71.75 -15.81 62.19 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.371 0.668 . . . . 0.0 111.489 178.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.412 ' O ' ' HA ' ' A' ' 1' ' ' ASN . . . 59.99 80.43 0.09 OUTLIER Glycine 0 N--CA 1.468 0.818 0 CA-C-O 123.63 1.684 . . . . 0.0 112.432 175.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -178.39 28.27 0.06 OUTLIER Glycine 0 C--O 1.223 -0.587 0 O-C-N 120.509 -1.583 . . . . 0.0 114.904 -176.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 52.0 m -133.7 159.71 39.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 123.54 0.736 . . . . 0.0 110.981 175.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.2 m -52.39 -48.59 65.54 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 124.175 0.99 . . . . 0.0 112.927 -179.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.58 -61.52 1.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.34 1.456 . . . . 0.0 110.557 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.3 p -144.35 153.27 15.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.682 0.753 . . . . 0.0 111.294 176.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 82.9 m -90.77 136.5 33.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.741 0.816 . . . . 0.0 109.109 171.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -114.29 137.37 51.88 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.995 1.318 . . . . 0.0 111.821 174.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -81.71 101.52 10.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.027 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 mt -62.75 -35.53 80.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.954 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.3 t -61.63 -38.94 89.51 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.524 1.53 . . . . 0.0 111.522 176.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -80.07 -36.66 35.26 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 177.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.7 mt -61.63 -60.29 3.9 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.336 1.054 . . . . 0.0 109.945 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.2 p -148.93 164.36 34.75 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.178 0.989 . . . . 0.0 112.502 -175.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -80.67 -23.63 59.79 Favored Glycine 0 CA--C 1.529 0.96 0 O-C-N 119.954 -1.716 . . . . 0.0 113.782 177.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.1 t -47.8 -55.48 9.58 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.678 1.739 . . . . 0.0 113.09 -176.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.1 mmtp -71.31 -40.2 70.97 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.32 -38.37 61.96 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 123.44 0.543 . . . . 0.0 113.372 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.3 mttm -80.15 11.84 3.22 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.943 1.697 . . . . 0.0 114.061 174.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.36 30.78 72.09 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.594 1.092 . . . . 0.0 113.276 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.64 163.7 40.7 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 123.507 0.575 . . . . 0.0 112.69 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -125.87 144.7 50.56 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.469 1.507 . . . . 0.0 111.115 -178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.25 128.88 38.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 121.132 -0.98 . . . . 0.0 110.332 176.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -130.74 146.8 63.53 Favored Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 121.45 -0.781 . . . . 0.0 111.654 177.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -66.06 157.86 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.368 2.045 . . . . 0.0 110.428 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.3 mt -62.08 -22.2 65.58 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -77.86 -13.43 59.89 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.646 1.578 . . . . 0.0 113.078 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -87.49 135.46 33.34 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 120.429 -1.419 . . . . 0.0 110.0 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -99.94 123.51 44.26 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.238 1.415 . . . . 0.0 110.371 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -165.65 178.55 6.58 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 125.275 1.43 . . . . 0.0 109.805 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -80.42 110.42 15.85 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 121.446 -0.784 . . . . 0.0 110.302 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -121.9 133.31 54.86 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.452 1.101 . . . . 0.0 111.35 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 13.3 tp -88.44 133.63 34.07 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.914 -1.116 . . . . 0.0 109.344 173.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -50.3 -40.38 48.41 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.029 1.732 . . . . 0.0 113.813 172.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.6 -25.75 66.77 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.791 1.236 . . . . 0.0 112.381 176.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -94.13 -28.49 15.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.233 1.013 . . . . 0.0 112.718 174.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.0 t -51.66 -38.5 55.19 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 125.658 1.583 . . . . 0.0 111.638 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.14 -44.13 67.52 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.289 1.436 . . . . 0.0 113.474 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 t -44.58 -55.96 4.73 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.138 1.775 . . . . 0.0 112.753 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 18.0 m -77.12 -58.48 3.26 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.485 172.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 36.87 -146.07 0.08 OUTLIER Glycine 0 N--CA 1.472 1.057 0 C-N-CA 128.504 2.954 . . . . 0.0 112.255 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 pttt 42.05 42.83 2.53 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 121.142 2.471 . . . . 0.0 117.174 172.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 86.26 17.05 61.47 Favored Glycine 0 CA--C 1.542 1.726 0 N-CA-C 115.36 0.904 . . . . 0.0 115.36 -174.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -142.16 152.55 43.3 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.042 2.537 . . . . 0.0 109.957 -177.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -129.09 160.84 31.54 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.842 -1.161 . . . . 0.0 109.986 176.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 47.6 t -97.91 107.41 19.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.394 0.678 . . . . 0.0 110.779 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.41 152.1 23.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.167 0.508 . . . . 0.0 110.978 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -117.93 146.8 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.093 0.957 . . . . 0.0 110.986 176.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -107.88 -73.34 0.69 Allowed 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.112 0.965 . . . . 0.0 111.771 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.68 175.41 4.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.034 0.921 . . . . 0.0 110.672 177.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 p80 . . . . . 0 C--O 1.253 1.264 0 CA-C-O 116.639 -1.648 . . . . 0.0 111.798 175.648 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -117.71 -32.41 4.85 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.337 -173.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -50.16 -48.22 54.02 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.409 0.683 . . . . 0.0 111.823 176.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.29 -33.91 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 124.78 1.232 . . . . 0.0 113.21 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -68.39 -28.18 66.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.138 1.375 . . . . 0.0 112.066 177.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -96.57 -5.69 38.62 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.04 40.84 28.92 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.862 0.755 . . . . 0.0 113.533 -176.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.51 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 57.0 m-85 -94.9 167.21 11.56 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.334 1.054 . . . . 0.0 112.918 172.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.51 127.5 7.89 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.437 1.018 . . . . 0.0 111.627 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.6 m -72.41 134.29 45.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.782 -0.834 . . . . 0.0 111.865 171.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 33.0 mt -142.73 163.47 38.38 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.257 175.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.55 137.51 39.43 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.116 2.544 . . . . 0.0 112.203 172.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -52.75 -17.1 1.17 Allowed 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -46.44 56.49 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.342 1.857 . . . . 0.0 112.041 171.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.05 -35.98 28.18 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.581 1.152 . . . . 0.0 112.107 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.5 t -87.26 109.47 25.77 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.757 -1.215 . . . . 0.0 112.08 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.06 150.66 87.64 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.933 2.422 . . . . 0.0 111.509 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -55.05 -18.38 5.22 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -78.74 -33.16 46.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.525 1.53 . . . . 0.0 112.931 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.81 -17.15 23.41 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.52 1.528 . . . . 0.0 112.666 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -51.75 109.48 0.36 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.09 0.956 . . . . 0.0 111.873 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 36.9 mt -86.03 170.54 12.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.915 0.864 . . . . 0.0 111.882 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.3 t -120.13 22.05 11.56 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.961 1.305 . . . . 0.0 112.224 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.51 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 60.4 m-85 -70.29 -19.68 63.08 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 175.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.26 73.04 0.5 Allowed Glycine 0 N--CA 1.471 0.985 0 O-C-N 120.608 -1.308 . . . . 0.0 113.684 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -167.02 30.19 0.19 Allowed Glycine 0 N--CA 1.464 0.507 0 O-C-N 120.407 -1.643 . . . . 0.0 114.163 -176.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 59.9 m -130.55 163.22 27.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.195 0.998 . . . . 0.0 112.109 178.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.0 m -59.08 -31.43 68.88 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.837 1.255 . . . . 0.0 113.198 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 t -144.75 -55.22 0.33 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.605 1.162 . . . . 0.0 111.933 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.3 p -146.27 151.24 14.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-O 122.357 1.075 . . . . 0.0 110.945 174.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 14.2 m -87.83 139.11 30.85 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.233 1.013 . . . . 0.0 108.646 170.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.4 136.52 53.12 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.669 0.788 . . . . 0.0 112.042 174.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -78.49 102.77 8.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.849 0.833 . . . . 0.0 111.672 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.9 mt -58.34 -38.2 76.68 Favored 'General case' 0 C--O 1.221 -0.44 0 O-C-N 121.686 -0.634 . . . . 0.0 111.642 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 t -61.52 -37.31 83.26 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.343 1.057 . . . . 0.0 111.819 178.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.0 mtpt -77.48 -41.64 38.75 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 175.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.5 mt -63.53 -59.78 4.19 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.46 0.704 . . . . 0.0 111.218 177.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -172.83 144.61 1.35 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 123.324 1.535 . . . . 0.0 113.774 -174.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -79.68 7.97 51.52 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 116.874 -2.07 . . . . 0.0 115.597 174.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.9 t -56.95 -55.34 35.92 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 122.511 3.155 . . . . 0.0 111.341 -165.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.65 -28.98 56.22 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.87 1.268 . . . . 0.0 113.65 171.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -78.83 -27.05 57.43 Favored Glycine 0 CA--C 1.535 1.302 0 O-C-N 121.309 -0.87 . . . . 0.0 114.91 -173.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.78 9.08 12.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.187 2.595 . . . . 0.0 112.713 173.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 83.58 31.21 27.86 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.617 1.58 . . . . 0.0 114.206 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -113.79 179.91 18.93 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.332 1.066 . . . . 0.0 113.112 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -150.52 157.13 42.66 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.807 0.843 . . . . 0.0 111.152 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.0 t -63.5 126.86 28.88 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.046 -1.034 . . . . 0.0 110.807 174.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -124.92 152.89 70.75 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.17 0.988 . . . . 0.0 111.357 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.18 156.76 46.68 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.356 2.037 . . . . 0.0 111.524 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.0 mt -62.52 -24.42 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 178.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -71.8 -19.52 61.99 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.891 1.276 . . . . 0.0 113.747 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -79.24 127.47 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.981 -1.074 . . . . 0.0 110.522 173.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -91.13 117.62 29.76 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.715 0.806 . . . . 0.0 111.498 172.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.66 174.39 10.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.988 176.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 tptt -72.93 124.68 25.92 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.44 -0.788 . . . . 0.0 109.236 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -123.79 142.16 51.36 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 124.808 1.243 . . . . 0.0 110.214 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.75 152.36 19.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.852 0.834 . . . . 0.0 110.355 174.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 mp0 -73.24 -38.6 65.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.389 -0.819 . . . . 0.0 110.648 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.18 58.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.317 0.647 . . . . 0.0 112.638 177.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -82.48 -43.16 17.55 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.909 0.884 . . . . 0.0 111.111 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.2 p -58.25 -31.88 67.82 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.959 -1.713 . . . . 0.0 112.096 178.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.75 -38.24 64.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.975 1.31 . . . . 0.0 113.341 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -57.96 -49.14 77.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.72 1.608 . . . . 0.0 114.107 -176.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 m -75.73 -59.16 2.87 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 169.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 38.8 -143.6 0.3 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 126.077 1.799 . . . . 0.0 112.017 -175.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? 48.23 35.56 5.63 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.02 1.859 . . . . 0.0 116.02 171.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.26 21.19 42.4 Favored Glycine 0 CA--C 1.538 1.486 0 N-CA-C 115.174 0.83 . . . . 0.0 115.174 -172.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -136.78 157.0 47.77 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.342 2.257 . . . . 0.0 111.373 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -134.49 142.17 46.97 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.399 1.88 . . . . 0.0 109.724 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.4 m -86.8 115.45 24.23 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 120.823 -1.173 . . . . 0.0 110.015 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 18.3 m -110.41 152.1 26.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.449 0.642 . . . . 0.0 112.155 176.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.2 p -123.66 143.9 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.601 0.761 . . . . 0.0 110.475 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.5 m95 -104.06 179.11 4.37 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.465 1.106 . . . . 0.0 110.939 175.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.3 mt -54.84 125.08 18.66 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.254 1.022 . . . . 0.0 110.727 167.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.1 m170 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 115.738 -2.077 . . . . 0.0 112.173 174.551 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 5.3 p30 . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -120.38 -30.58 4.54 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.513 1.133 . . . . 0.0 112.033 -173.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.505 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 86.0 m -51.96 -46.71 64.88 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.514 1.126 . . . . 0.0 111.4 176.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.81 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.799 1.24 . . . . 0.0 112.023 176.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.2 t -67.63 -23.89 65.4 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.242 1.017 . . . . 0.0 112.093 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.424 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.3 OUTLIER -99.32 -2.12 37.19 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 171.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.18 31.92 58.93 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 118.578 -1.124 . . . . 0.0 113.179 -178.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.424 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 45.4 m-85 -88.01 166.74 14.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.275 1.43 . . . . 0.0 112.636 174.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.11 129.25 8.01 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 125.021 1.296 . . . . 0.0 110.835 -178.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.4 m -69.16 124.8 24.77 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.066 0.546 . . . . 0.0 111.578 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 mt -131.57 162.73 54.39 Favored Pre-proline 0 CA--C 1.538 0.507 0 O-C-N 124.084 0.865 . . . . 0.0 110.861 174.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.47 138.51 35.73 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 123.003 2.468 . . . . 0.0 110.576 172.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -52.51 -18.38 1.67 Allowed 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.1 t -74.5 -45.33 46.61 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.63 1.972 . . . . 0.0 112.533 171.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -74.99 -43.16 55.51 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.357 1.063 . . . . 0.0 110.971 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.7 t -84.82 119.23 72.48 Favored Pre-proline 0 C--O 1.242 0.698 0 C-N-CA 123.348 0.659 . . . . 0.0 111.906 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.4 148.23 92.86 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.471 2.114 . . . . 0.0 110.869 -178.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -49.98 -28.08 6.33 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 173.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.02 -32.84 67.54 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 174.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.38 -17.87 26.49 Favored 'General case' 0 N--CA 1.46 0.064 0 C-N-CA 125.349 1.46 . . . . 0.0 113.539 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 90.4 mtt180 -51.72 105.91 0.13 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.479 -0.763 . . . . 0.0 111.443 173.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 47.3 mt -84.64 167.33 16.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.487 1.137 . . . . 0.0 111.194 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 p -116.59 18.18 15.09 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.822 1.649 . . . . 0.0 112.426 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.505 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 51.2 m-85 -66.93 -9.21 35.81 Favored 'General case' 0 C--O 1.211 -0.921 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.17 57.37 19.5 Favored Glycine 0 N--CA 1.472 1.095 0 O-C-N 120.444 -1.41 . . . . 0.0 113.098 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -147.22 23.55 1.57 Allowed Glycine 0 C--O 1.226 -0.404 0 CA-C-O 118.767 -1.018 . . . . 0.0 115.575 -172.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 58.8 m -141.39 143.6 34.04 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.216 1.006 . . . . 0.0 111.134 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.3 m -50.24 -43.87 53.17 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.837 1.255 . . . . 0.0 113.37 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.52 -73.49 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.508 1.923 . . . . 0.0 110.509 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -148.09 153.8 11.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 123.839 0.856 . . . . 0.0 111.015 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 88.1 m -91.53 133.94 35.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.64 138.62 45.73 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.762 1.225 . . . . 0.0 112.038 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.562 ' OD2' ' HE2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -81.4 95.95 7.2 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 122.912 1.339 . . . . 0.0 114.415 178.953 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.15 -37.31 86.7 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 120.718 -1.239 . . . . 0.0 110.927 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.8 p -66.28 -36.61 83.41 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.008 -1.683 . . . . 0.0 113.263 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.562 ' HE2' ' OD2' ' A' ' 33' ' ' ASP . 15.6 mtmm -80.53 -35.59 34.31 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.361 1.465 . . . . 0.0 113.342 177.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.4 mt -89.95 -75.78 0.44 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.815 1.246 . . . . 0.0 110.71 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.9 t -161.72 139.04 8.66 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.032 1.333 . . . . 0.0 112.684 -177.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -112.99 52.88 0.61 Allowed Glycine 0 CA--C 1.521 0.44 0 CA-C-O 118.187 -1.34 . . . . 0.0 112.32 -178.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 15.1 t -47.77 -59.92 2.95 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.267 1.034 . . . . 0.0 110.257 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.56 -34.84 38.54 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 175.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.95 -37.43 60.57 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.567 1.08 . . . . 0.0 112.226 -178.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -80.28 8.09 8.17 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.099 1.36 . . . . 0.0 113.809 174.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.68 19.27 52.44 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.195 1.379 . . . . 0.0 114.069 -177.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.39 150.26 26.97 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 125.138 1.351 . . . . 0.0 112.77 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -140.55 145.65 37.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 124.657 1.183 . . . . 0.0 110.322 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 91.4 m -71.77 114.3 9.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.522 0.729 . . . . 0.0 111.912 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -117.33 148.72 43.24 Favored Pre-proline 0 C--O 1.241 0.618 0 C-N-CA 124.172 0.989 . . . . 0.0 110.581 -179.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.79 152.7 77.22 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 121.86 1.706 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.3 mt -60.61 -18.4 52.87 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.56 -24.27 56.66 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.049 1.739 . . . . 0.0 112.844 171.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -78.26 143.29 37.18 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 119.961 -1.712 . . . . 0.0 110.582 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -102.75 120.72 41.09 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 124.535 1.134 . . . . 0.0 111.371 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.6 p -169.5 173.23 6.57 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.236 1.414 . . . . 0.0 110.943 175.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -76.0 102.26 5.57 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.89 1.276 . . . . 0.0 110.955 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -118.73 139.64 51.23 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.49 1.116 . . . . 0.0 110.342 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 17.8 mt -87.92 126.31 34.98 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 123.106 0.563 . . . . 0.0 110.171 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -60.62 -39.35 87.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.335 0.654 . . . . 0.0 111.816 -178.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.34 -26.57 58.69 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.117 0.967 . . . . 0.0 113.023 175.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -88.67 -22.33 23.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.225 1.01 . . . . 0.0 112.327 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.8 p -54.91 -29.3 55.72 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.968 1.707 . . . . 0.0 112.708 175.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.64 49.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.328 1.451 . . . . 0.0 113.053 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.1 m -55.23 -42.77 73.85 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 174.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 73.8 m -80.37 -36.62 33.72 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.821 0.448 . . . . 0.0 111.678 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 110.36 170.39 19.75 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 122.954 1.308 . . . . 0.0 112.514 179.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -56.26 134.87 53.59 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.749 -1.442 . . . . 0.0 111.092 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.13 5.4 65.85 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.977 -0.902 . . . . 0.0 114.054 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -140.99 163.63 32.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.843 2.057 . . . . 0.0 110.225 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -123.9 162.05 24.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.76 1.624 . . . . 0.0 110.151 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -123.7 97.48 5.4 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.566 0.747 . . . . 0.0 110.95 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 93.8 m -97.72 138.67 34.76 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.338 1.055 . . . . 0.0 110.157 -178.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -105.17 145.76 13.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 124.136 0.974 . . . . 0.0 111.369 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.7 m95 -121.13 172.62 7.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 122.139 0.971 . . . . 0.0 110.839 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -59.94 165.8 3.05 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.751 167.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 . . . . . 0 C--O 1.253 1.251 0 CA-C-O 115.598 -2.144 . . . . 0.0 112.972 175.601 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 121.004 0.43 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -49.6 -58.28 5.55 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.985 0.914 . . . . 0.0 111.477 177.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.63 -31.22 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.322 0.649 . . . . 0.0 112.438 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.67 -29.45 69.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.636 1.174 . . . . 0.0 111.318 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 2.1 mmmp? -96.7 -9.53 28.87 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 117.286 -1.34 . . . . 0.0 114.169 174.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 84.25 34.42 17.38 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 125.107 1.504 . . . . 0.0 112.541 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.524 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 59.1 m-85 -87.58 170.53 11.23 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.985 1.314 . . . . 0.0 112.574 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.72 123.9 5.85 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.794 -0.923 . . . . 0.0 110.794 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -74.26 131.59 41.33 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 118.799 -0.62 . . . . 0.0 111.252 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 mt -144.72 160.67 46.54 Favored Pre-proline 0 CA--C 1.53 0.199 0 O-C-N 124.075 0.859 . . . . 0.0 111.071 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.624 ' HA ' HG21 ' A' ' 29' ' ' THR . 55.4 Cg_endo -67.07 137.73 45.25 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.484 2.789 . . . . 0.0 110.913 174.251 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.497 ' HA ' HG11 ' A' ' 30' ' ' VAL . 66.9 mt-30 -52.08 -23.17 4.9 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 175.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 t -70.38 -46.44 64.06 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 124.257 1.023 . . . . 0.0 113.208 171.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -72.85 -41.17 65.06 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.957 0.903 . . . . 0.0 110.197 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.1 t -85.38 124.44 71.69 Favored Pre-proline 0 CA--C 1.541 0.622 0 O-C-N 120.591 -1.318 . . . . 0.0 111.715 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -62.71 145.73 95.05 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.696 2.264 . . . . 0.0 110.494 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -52.87 -21.33 4.14 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.72 -34.08 40.35 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.671 1.588 . . . . 0.0 112.62 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.61 -25.14 28.79 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 117.881 -1.056 . . . . 0.0 112.481 177.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -49.18 111.35 0.47 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.176 0.898 . . . . 0.0 110.933 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.7 mt -93.8 174.71 7.04 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.725 0.774 . . . . 0.0 109.879 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 m -115.14 25.24 11.03 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.009 1.324 . . . . 0.0 111.86 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.524 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 52.0 m-85 -67.93 -11.72 59.3 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.865 175.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 45.0 80.42 0.05 OUTLIER Glycine 0 N--CA 1.473 1.166 0 CA-C-N 120.882 1.673 . . . . 0.0 114.404 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 177.64 27.73 0.04 OUTLIER Glycine 0 C--O 1.226 -0.355 0 O-C-N 120.643 -1.504 . . . . 0.0 113.401 -174.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.7 m -125.89 159.26 33.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.762 0.825 . . . . 0.0 110.872 176.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.4 p -43.18 -43.58 4.73 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.463 1.105 . . . . 0.0 112.899 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.624 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.3 t -137.81 -61.82 0.61 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.963 1.705 . . . . 0.0 111.311 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.542 ' H ' HG23 ' A' ' 29' ' ' THR . 7.8 p -138.57 151.62 24.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 122.132 0.968 . . . . 0.0 110.387 179.028 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -90.76 134.1 34.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.26 173.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.81 141.26 41.09 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.113 0.965 . . . . 0.0 111.826 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -81.32 103.19 10.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.46 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.4 mt -63.61 -32.71 74.26 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 121.063 -1.023 . . . . 0.0 110.825 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.5 t . . . . . 0 N--CA 1.466 0.36 0 O-C-N 119.352 -2.093 . . . . 0.0 112.709 176.694 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.4 mttm . . . . . 0 N--CA 1.468 0.449 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.71 -34.98 79.44 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-O 119.695 -0.503 . . . . 0.0 113.354 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -80.07 14.82 1.7 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.627 1.171 . . . . 0.0 113.781 173.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.05 45.15 52.36 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 123.791 0.71 . . . . 0.0 113.265 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -124.43 159.66 19.05 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.594 1.568 . . . . 0.0 112.764 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -147.51 153.55 39.65 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.676 1.227 . . . . 0.0 111.477 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.2 m -64.34 124.31 21.41 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.927 -1.108 . . . . 0.0 112.507 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -122.64 147.97 51.96 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-O 122.019 0.914 . . . . 0.0 111.258 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.23 153.24 71.68 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.212 1.941 . . . . 0.0 110.416 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.641 HD22 ' HE3' ' A' ' 69' ' ' LYS . 21.5 mt -60.08 -22.06 62.25 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 175.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.66 -18.59 60.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.015 1.326 . . . . 0.0 112.591 175.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.9 tpp85 -87.27 127.66 35.17 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.454 176.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.03 119.38 19.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.742 175.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.2 t -165.69 176.05 8.34 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.214 1.006 . . . . 0.0 110.401 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -96.91 110.45 22.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.779 1.231 . . . . 0.0 110.466 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -111.01 138.12 47.81 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.455 1.102 . . . . 0.0 110.727 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 13.2 mt -89.16 153.2 21.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.455 -0.778 . . . . 0.0 110.433 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -63.92 -36.28 83.41 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.416 -0.802 . . . . 0.0 112.102 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.1 50.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.486 0.714 . . . . 0.0 112.285 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -81.24 -33.61 32.7 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.2 m -56.27 -31.46 63.62 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.051 -1.031 . . . . 0.0 112.16 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -40.08 70.11 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.338 1.055 . . . . 0.0 112.746 175.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -48.0 -58.64 4.17 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.423 1.489 . . . . 0.0 111.938 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.7 m -64.36 -49.64 70.86 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.593 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.13 -169.68 12.97 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-O 123.097 1.387 . . . . 0.0 112.759 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -64.94 136.74 57.18 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.713 -1.463 . . . . 0.0 111.73 177.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.05 5.33 89.33 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 119.328 -0.707 . . . . 0.0 113.56 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -136.89 161.14 36.82 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.734 1.214 . . . . 0.0 110.951 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.641 ' HE3' HD22 ' A' ' 50' ' ' LEU . 43.9 mttt -138.47 121.4 16.61 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.759 1.224 . . . . 0.0 110.659 -178.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.6 t -73.8 106.92 5.74 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.7 -0.625 . . . . 0.0 111.048 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.457 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.9 OUTLIER -91.21 151.84 20.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.402 0.62 . . . . 0.0 110.662 177.153 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.75 145.48 34.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 124.209 1.003 . . . . 0.0 110.601 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.457 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 47.2 m95 . . . . . 0 C--O 1.222 -0.37 0 CA-C-O 121.569 0.699 . . . . 0.0 111.51 175.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.472 0.672 0 CA-C-O 120.754 0.311 . . . . 0.0 111.732 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.554 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 63.3 m -51.5 -56.61 12.44 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.743 1.217 . . . . 0.0 110.201 176.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.18 -32.06 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.532 1.133 . . . . 0.0 113.827 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.5 t -61.23 -33.73 73.97 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.063 1.345 . . . . 0.0 111.37 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -96.03 -5.82 40.17 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 82.61 30.06 34.0 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-O 117.695 -1.614 . . . . 0.0 113.347 -177.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -75.11 168.66 19.56 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.458 1.629 . . . . 0.0 112.936 174.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.81 114.63 3.17 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.293 1.425 . . . . 0.0 111.435 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.5 m -66.04 131.45 46.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.748 172.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.418 ' O ' HG13 ' A' ' 30' ' ' VAL . 51.8 mt -145.11 155.63 54.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 124.04 0.838 . . . . 0.0 111.496 176.23 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.499 ' HA ' HG21 ' A' ' 29' ' ' THR . 58.2 Cg_endo -63.43 138.27 64.66 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.509 2.139 . . . . 0.0 110.587 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -25.55 1.99 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 p -71.09 -41.17 70.98 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.998 0.919 . . . . 0.0 112.921 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -78.91 -46.22 18.92 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.822 1.649 . . . . 0.0 111.567 176.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.3 t -88.08 121.67 70.41 Favored Pre-proline 0 C--O 1.244 0.799 0 C-N-CA 124.142 0.977 . . . . 0.0 111.485 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -61.47 144.5 98.06 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.74 2.293 . . . . 0.0 110.5 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.2 pp0? -47.38 -30.12 3.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.214 1.006 . . . . 0.0 113.688 175.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -69.7 -32.97 71.87 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.962 1.305 . . . . 0.0 113.739 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.67 -20.42 21.62 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.749 1.22 . . . . 0.0 112.506 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.518 ' HG2' HG21 ' A' ' 30' ' ' VAL . 73.5 mtt180 -51.1 100.34 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 112.272 173.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 41.9 mt -84.28 166.41 17.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.967 0.889 . . . . 0.0 111.214 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -113.79 29.3 8.1 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.184 1.794 . . . . 0.0 112.277 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.554 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 15.2 m-85 -68.17 -17.95 64.48 Favored 'General case' 0 C--O 1.211 -0.944 0 O-C-N 121.255 -0.903 . . . . 0.0 112.57 175.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.1 74.38 0.41 Allowed Glycine 0 N--CA 1.473 1.11 0 CA-C-O 123.767 1.759 . . . . 0.0 113.29 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.73 36.54 0.07 OUTLIER Glycine 0 C--O 1.224 -0.47 0 O-C-N 120.691 -1.476 . . . . 0.0 112.299 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 53.3 m -134.75 160.95 36.57 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 117.012 0.406 . . . . 0.0 111.545 170.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.8 m -54.68 -37.61 65.98 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.121 0.969 . . . . 0.0 112.966 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -135.44 -56.34 0.79 Allowed 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.279 1.432 . . . . 0.0 110.382 -179.474 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.518 HG21 ' HG2' ' A' ' 21' ' ' ARG . 2.4 p -152.76 145.49 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.992 0.917 . . . . 0.0 111.898 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 61.2 m -86.2 134.33 33.79 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.091 172.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.62 146.59 29.48 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.108 0.963 . . . . 0.0 110.962 172.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -86.21 107.35 17.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.723 0.809 . . . . 0.0 112.05 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.34 -29.56 70.54 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.469 -0.77 . . . . 0.0 111.704 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.4 m . . . . . 0 N--CA 1.47 0.534 0 O-C-N 119.818 -1.801 . . . . 0.0 113.087 176.246 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.532 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.18 65.92 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-N 118.261 0.482 . . . . 0.0 113.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -88.75 12.27 15.41 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.015 1.726 . . . . 0.0 113.52 173.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.47 40.47 9.92 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.691 1.139 . . . . 0.0 112.411 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.14 165.02 31.33 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 121.566 0.537 . . . . 0.0 113.578 174.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -146.93 154.61 41.48 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.912 1.285 . . . . 0.0 112.081 -176.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.0 t -73.28 127.14 31.79 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.716 -1.24 . . . . 0.0 110.604 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -126.33 149.93 68.66 Favored Pre-proline 0 CA--C 1.543 0.695 0 C-N-CA 123.607 0.763 . . . . 0.0 111.074 -178.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.28 158.91 55.51 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.524 2.15 . . . . 0.0 111.744 176.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.421 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 16.0 mt -61.71 -19.79 62.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.525 0.73 . . . . 0.0 112.935 176.087 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -80.99 -15.41 56.29 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.004 2.122 . . . . 0.0 112.618 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -87.12 137.33 32.44 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 120.962 -1.087 . . . . 0.0 109.718 174.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.6 120.41 28.89 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.793 1.237 . . . . 0.0 111.075 172.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.13 -177.91 5.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.003 0.921 . . . . 0.0 110.361 174.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.62 112.51 22.39 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.357 -0.839 . . . . 0.0 110.404 170.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.28 133.03 50.21 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.308 1.443 . . . . 0.0 113.02 177.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mt -87.52 154.77 20.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 120.435 -1.416 . . . . 0.0 110.265 177.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -68.3 -36.79 79.87 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.92 -37.56 67.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.062 0.545 . . . . 0.0 110.993 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -75.99 -30.5 58.58 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.1 t -49.08 -44.77 42.29 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.273 0.629 . . . . 0.0 112.179 171.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.62 -38.75 72.51 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.511 -0.757 . . . . 0.0 112.978 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.6 t -51.11 -44.75 61.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.527 1.531 . . . . 0.0 112.725 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.8 m -68.4 -60.29 2.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.409 0.684 . . . . 0.0 112.152 172.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 136.55 -156.73 23.26 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 122.387 0.993 . . . . 0.0 113.816 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -80.88 133.14 35.52 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.762 -1.434 . . . . 0.0 111.574 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.24 10.0 84.29 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 123.916 0.77 . . . . 0.0 114.381 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -137.56 155.14 49.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.013 1.325 . . . . 0.0 109.948 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 19.3 mmtp -136.26 131.04 33.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.503 1.921 . . . . 0.0 109.437 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.4 t -73.56 111.04 8.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.404 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 40.5 m -106.21 161.29 14.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.557 0.694 . . . . 0.0 111.724 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p -129.59 144.16 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 123.556 0.743 . . . . 0.0 111.121 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.4 m95 . . . . . 0 C--O 1.235 0.315 0 CA-C-O 122.484 1.135 . . . . 0.0 111.008 174.901 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 . . . . . 0 N--CA 1.471 0.595 0 CA-C-O 120.809 0.338 . . . . 0.0 111.34 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.634 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 87.4 m -50.83 -51.26 52.85 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.093 -1.004 . . . . 0.0 111.109 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -59.33 -32.35 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.202 1.001 . . . . 0.0 113.302 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.4 t -67.04 -29.07 68.77 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.66 1.584 . . . . 0.0 111.309 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.434 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 35.1 mmtt -94.31 -5.59 46.32 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 172.664 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.08 37.22 25.74 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-O 118.293 -1.282 . . . . 0.0 112.947 -177.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.43 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 43.1 m-85 -98.87 161.53 13.58 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.636 1.975 . . . . 0.0 112.216 174.019 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.72 130.49 9.12 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.303 0.954 . . . . 0.0 111.528 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.3 134.2 48.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 118.105 -0.95 . . . . 0.0 111.939 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.2 mt -145.39 156.15 53.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 O-C-N 123.741 0.651 . . . . 0.0 110.986 175.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -66.81 140.08 54.34 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.377 2.052 . . . . 0.0 110.4 174.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -49.4 -23.58 1.57 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 174.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 p -70.78 -44.48 66.57 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.651 1.18 . . . . 0.0 112.698 173.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -79.67 -42.22 25.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.923 1.689 . . . . 0.0 111.766 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.5 t -89.73 122.22 68.28 Favored Pre-proline 0 C--O 1.245 0.865 0 C-N-CA 124.525 1.13 . . . . 0.0 111.847 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.18 146.73 94.27 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.866 2.377 . . . . 0.0 110.85 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -51.39 -29.08 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -70.2 -24.65 63.16 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.67 -17.53 17.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.446 1.899 . . . . 0.0 113.984 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.506 ' HG2' HG21 ' A' ' 30' ' ' VAL . 85.4 mtt180 -57.11 101.33 0.06 Allowed 'General case' 0 N--CA 1.463 0.186 0 O-C-N 121.307 -0.871 . . . . 0.0 111.113 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 33' ' ' ASP . 53.8 mt -85.21 168.12 15.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 122.406 1.098 . . . . 0.0 110.815 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -120.59 30.6 6.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.428 1.891 . . . . 0.0 112.403 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.634 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 38.6 m-85 -67.46 -16.48 64.24 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 121.535 -0.728 . . . . 0.0 112.667 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.07 67.07 2.14 Favored Glycine 0 N--CA 1.469 0.897 0 CA-C-N 119.825 1.193 . . . . 0.0 112.831 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -164.34 25.24 0.18 Allowed Glycine 0 N--CA 1.462 0.426 0 O-C-N 120.983 -1.304 . . . . 0.0 114.276 -177.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 55.4 m -132.39 151.03 52.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.866 0.866 . . . . 0.0 111.541 175.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.9 m -53.36 -41.82 66.21 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.191 0.997 . . . . 0.0 112.941 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.0 -72.64 0.68 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.993 1.717 . . . . 0.0 109.581 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.506 HG21 ' HG2' ' A' ' 21' ' ' ARG . 3.3 p -143.97 140.62 25.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.413 1.085 . . . . 0.0 111.227 -177.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 97.4 m -79.8 137.89 37.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.043 -1.036 . . . . 0.0 109.477 172.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.67 133.22 53.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.349 1.06 . . . . 0.0 111.766 172.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.658 ' HB3' HD11 ' A' ' 22' ' ' LEU . 1.1 p30 -80.27 97.22 6.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 123.436 1.589 . . . . 0.0 113.937 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 mt -59.24 -41.26 88.29 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 119.785 -1.822 . . . . 0.0 110.955 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.511 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.229 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.74 -27.98 69.24 Favored Glycine 0 CA--C 1.534 1.245 0 CA-C-O 119.358 -0.69 . . . . 0.0 112.978 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -86.27 13.25 8.32 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.391 2.276 . . . . 0.0 113.318 173.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.34 37.16 54.53 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-N 118.252 0.478 . . . . 0.0 113.055 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.14 162.18 13.19 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 125.639 1.59 . . . . 0.0 113.466 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -142.95 150.12 39.29 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 124.756 1.222 . . . . 0.0 109.894 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 96.5 m -61.89 114.46 3.37 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.388 -0.82 . . . . 0.0 111.8 174.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -116.14 148.23 41.06 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.521 1.128 . . . . 0.0 111.015 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.48 152.26 78.85 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.774 2.316 . . . . 0.0 111.186 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.5 mt -60.75 -20.92 62.38 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.98 -20.26 59.74 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.528 1.531 . . . . 0.0 112.468 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -86.03 128.17 34.81 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 120.781 -1.199 . . . . 0.0 109.959 176.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.82 118.87 23.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.493 0.717 . . . . 0.0 110.926 174.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.19 173.86 11.89 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.516 1.126 . . . . 0.0 110.354 176.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.3 ttmt -82.33 114.32 20.72 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.84 129.77 51.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.608 1.563 . . . . 0.0 112.316 177.205 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 21.9 tp -85.47 136.08 33.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 120.642 -1.286 . . . . 0.0 110.067 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -54.12 -38.1 65.06 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.695 -1.253 . . . . 0.0 113.982 172.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.48 -33.53 74.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.025 0.93 . . . . 0.0 110.546 177.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -79.32 -33.02 43.51 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.232 1.013 . . . . 0.0 112.206 178.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.41 ' CB ' ' HD3' ' A' ' 69' ' ' LYS . 24.7 p -55.07 -28.86 55.54 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.224 1.01 . . . . 0.0 113.477 176.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.84 -35.26 77.73 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.404 1.082 . . . . 0.0 112.851 174.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.8 t -56.48 -45.54 80.88 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.877 1.271 . . . . 0.0 112.179 178.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 66.6 m -74.91 -43.11 56.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.299 0.64 . . . . 0.0 112.512 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 114.93 -146.75 18.86 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 122.414 1.008 . . . . 0.0 112.586 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -87.62 147.04 25.46 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.116 -1.226 . . . . 0.0 111.947 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.87 6.92 74.25 Favored Glycine 0 CA--C 1.538 1.51 0 N-CA-C 114.272 0.469 . . . . 0.0 114.272 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -138.51 153.45 48.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.486 1.514 . . . . 0.0 109.754 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.41 ' HD3' ' CB ' ' A' ' 61' ' ' SER . 14.8 mmtp -134.14 125.49 28.02 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 126.252 1.821 . . . . 0.0 110.179 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.56 107.81 7.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 118.988 -0.529 . . . . 0.0 110.584 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 24.9 m -98.4 157.5 16.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 123.147 0.579 . . . . 0.0 111.94 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.1 t -106.0 138.08 33.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 110.9 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.6 m95 . . . . . 0 N--CA 1.467 0.378 0 N-CA-C 114.881 1.438 . . . . 0.0 114.881 176.427 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 . . . . . 0 N--CA 1.471 0.601 0 CA-C-O 121.436 0.636 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -54.82 -58.77 6.23 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.303 -0.873 . . . . 0.0 111.348 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.2 p -58.01 -33.46 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 m -63.12 -28.57 70.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.217 1.007 . . . . 0.0 111.077 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.4 mmmp? -96.57 -10.59 26.89 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 173.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.52 36.73 7.86 Favored Glycine 0 CA--C 1.52 0.404 0 CA-C-O 118.488 -1.173 . . . . 0.0 112.097 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -97.41 165.44 12.01 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.763 1.282 . . . . 0.0 111.786 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.86 131.69 10.09 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 111.273 -0.731 . . . . 0.0 111.273 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.8 m -79.4 123.74 27.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 O-C-N 122.085 -0.656 . . . . 0.0 110.791 176.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.474 ' O ' HG12 ' A' ' 30' ' ' VAL . 31.9 mt -138.62 155.01 73.7 Favored Pre-proline 0 C--O 1.218 -0.602 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.725 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -63.77 139.79 70.7 Favored 'Trans proline' 0 C--O 1.219 -0.44 0 C-N-CA 124.333 3.355 . . . . 0.0 110.488 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.443 ' HA ' HG11 ' A' ' 30' ' ' VAL . 28.3 mp0 -51.62 -26.98 9.95 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 176.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 m -65.57 -46.81 78.05 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.893 0.877 . . . . 0.0 113.155 170.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -75.97 -36.59 59.2 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.509 0.723 . . . . 0.0 112.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.4 t -89.24 121.37 69.52 Favored Pre-proline 0 C--O 1.241 0.632 0 O-C-N 121.089 -1.007 . . . . 0.0 111.823 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -62.96 146.96 95.03 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.651 2.234 . . . . 0.0 110.545 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -52.05 -19.72 2.04 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.91 -32.54 27.21 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.637 1.175 . . . . 0.0 113.052 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.81 -20.58 25.89 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.078 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HD3' HG21 ' A' ' 30' ' ' VAL . 60.0 mtt180 -55.24 119.27 5.28 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.429 0.692 . . . . 0.0 110.078 175.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.0 mt -102.71 175.92 5.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.791 0.805 . . . . 0.0 110.272 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.3 29.85 7.55 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.26 1.024 . . . . 0.0 111.593 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -67.93 -18.36 64.74 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 121.341 -0.849 . . . . 0.0 111.914 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.89 49.97 67.26 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 120.734 -1.229 . . . . 0.0 112.441 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -142.7 33.65 1.85 Allowed Glycine 0 C--O 1.225 -0.458 0 CA-C-O 118.032 -1.427 . . . . 0.0 113.5 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -142.44 150.54 40.72 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.107 0.963 . . . . 0.0 111.777 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.1 m -58.67 -45.56 89.12 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 123.765 0.666 . . . . 0.0 111.416 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 58.4 p -105.66 -75.79 0.62 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.222 0.609 . . . . 0.0 109.594 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.572 HG21 ' HD3' ' A' ' 21' ' ' ARG . 7.7 p -148.16 148.0 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 126.014 1.726 . . . . 0.0 110.49 179.117 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.85 131.34 35.85 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.127 -0.983 . . . . 0.0 110.891 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.22 139.11 45.73 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.384 1.074 . . . . 0.0 111.737 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -81.09 101.2 9.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.808 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.47 -19.42 64.72 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.246 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 N--CA 1.472 0.65 0 CA-C-N 120.105 1.32 . . . . 0.0 112.336 176.081 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt . . . . . 0 C--O 1.221 -0.43 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.1 -39.3 63.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.889 0.757 . . . . 0.0 113.083 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.0 mttm -79.31 11.92 2.66 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.444 1.098 . . . . 0.0 113.487 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.8 39.43 96.76 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.171 0.891 . . . . 0.0 112.292 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.69 172.17 46.07 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 121.954 0.752 . . . . 0.0 112.376 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -136.16 150.1 48.91 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 123.012 1.386 . . . . 0.0 112.434 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.5 t -79.17 135.69 36.88 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 120.753 -1.217 . . . . 0.0 111.662 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -133.28 148.06 67.51 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 124.061 0.944 . . . . 0.0 111.23 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.94 159.13 54.29 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.657 2.238 . . . . 0.0 110.896 177.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.421 HD11 ' HA2' ' A' ' 67' ' ' GLY . 28.7 mt -61.92 -16.73 53.08 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 175.275 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -84.61 -13.51 51.42 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 123.617 1.675 . . . . 0.0 111.963 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -92.83 130.59 38.39 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 118.783 -2.448 . . . . 0.0 110.246 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -85.12 121.55 28.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.333 176.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.496 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 1.8 t -162.1 176.44 10.69 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.903 0.881 . . . . 0.0 110.688 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.3 ttmt -94.87 108.25 20.28 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.04 0.936 . . . . 0.0 111.611 175.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.83 132.04 53.38 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.766 1.226 . . . . 0.0 111.094 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 58' ' ' GLN . 15.6 tp -77.69 137.7 38.65 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.009 -1.057 . . . . 0.0 109.593 176.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.439 ' N ' HD12 ' A' ' 57' ' ' LEU . 5.9 pt20 -53.34 -40.15 64.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.754 -1.216 . . . . 0.0 113.521 173.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.66 -24.19 63.58 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.878 0.871 . . . . 0.0 111.828 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -88.98 -31.06 18.31 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.467 1.107 . . . . 0.0 112.596 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 51.6 p -53.83 -28.04 33.28 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.828 1.251 . . . . 0.0 112.024 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.46 74.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.391 1.076 . . . . 0.0 112.332 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 m -56.93 -56.94 15.18 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.862 1.265 . . . . 0.0 111.307 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.33 -43.78 96.1 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.02 171.74 19.49 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 122.917 1.287 . . . . 0.0 112.271 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -56.58 135.41 54.71 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.464 -1.021 . . . . 0.0 110.764 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.421 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 86.28 9.87 75.45 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.852 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -144.56 169.05 18.71 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 110.795 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -131.77 156.62 45.66 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.558 1.543 . . . . 0.0 110.878 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.9 t -121.3 95.23 4.6 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.218 0.607 . . . . 0.0 111.545 -178.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.1 t -83.65 162.95 20.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -115.34 144.66 22.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 124.621 1.168 . . . . 0.0 111.213 174.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.496 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 33.3 m95 . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 122.28 1.038 . . . . 0.0 112.586 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 . . . . . 0 N--CA 1.476 0.834 0 CA-C-O 122.064 0.935 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 61.5 m -57.38 -55.27 36.93 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 120.546 -1.346 . . . . 0.0 110.83 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -59.31 -29.65 42.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 122.606 0.363 . . . . 0.0 111.913 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -70.44 -27.88 64.59 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.687 0.795 . . . . 0.0 111.119 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.499 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 22.4 mmmt -95.5 -3.64 46.32 Favored 'General case' 0 C--N 1.338 0.106 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.7 42.25 11.64 Favored Glycine 0 C--O 1.225 -0.463 0 O-C-N 124.348 1.03 . . . . 0.0 111.323 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.496 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 38.3 m-85 -106.36 162.31 13.8 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 124.254 1.021 . . . . 0.0 111.581 176.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.49 140.68 16.21 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.879 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.9 m -79.97 117.11 20.52 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 122.885 0.474 . . . . 0.0 111.398 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.502 ' O ' HG12 ' A' ' 30' ' ' VAL . 53.2 mt -132.35 154.43 81.59 Favored Pre-proline 0 C--O 1.214 -0.791 0 O-C-N 123.576 0.547 . . . . 0.0 111.722 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -64.54 140.96 71.44 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 123.794 2.996 . . . . 0.0 110.622 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.525 ' HA ' HG11 ' A' ' 30' ' ' VAL . 65.3 mt-30 -51.2 -25.48 5.53 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 177.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 91.3 p -68.8 -46.91 67.43 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 171.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.439 ' OD2' HD22 ' A' ' 11' ' ' LEU . 28.5 t0 -72.64 -34.51 67.34 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.886 0.874 . . . . 0.0 111.911 176.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.6 t -92.84 126.65 50.82 Favored Pre-proline 0 CA--C 1.539 0.55 0 O-C-N 120.884 -1.135 . . . . 0.0 111.917 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -63.82 147.36 92.32 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.609 2.206 . . . . 0.0 110.671 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -19.53 3.71 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 172.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -81.73 -31.82 31.85 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 123.893 0.877 . . . . 0.0 112.197 175.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.89 -24.62 23.59 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -45.97 117.56 1.56 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.619 0.768 . . . . 0.0 110.376 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.4 HD11 ' HB3' ' A' ' 33' ' ' ASP . 51.7 mt -103.22 174.61 5.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.337 1.065 . . . . 0.0 109.995 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -128.1 31.46 5.07 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.732 0.813 . . . . 0.0 111.177 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.509 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 33.0 m-85 -69.0 -17.53 63.93 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 121.226 -0.921 . . . . 0.0 112.065 177.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.36 88.03 0.05 OUTLIER Glycine 0 CA--C 1.532 1.104 0 CA-C-O 124.51 2.172 . . . . 0.0 111.857 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.24 25.97 0.03 OUTLIER Glycine 0 C--O 1.224 -0.506 0 O-C-N 119.909 -1.936 . . . . 0.0 113.652 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 67.7 m -137.24 149.79 47.4 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 123.415 0.686 . . . . 0.0 111.454 177.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -61.86 -42.6 99.24 Favored 'General case' 0 C--O 1.222 -0.371 0 O-C-N 124.364 1.04 . . . . 0.0 111.291 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.5 p -107.67 -75.19 0.64 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.395 0.678 . . . . 0.0 110.245 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.525 HG11 ' HA ' ' A' ' 13' ' ' GLN . 8.4 p -151.05 143.6 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.919 1.343 . . . . 0.0 111.06 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 91.9 m -82.0 124.17 29.55 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.279 -1.513 . . . . 0.0 110.259 173.173 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.89 142.99 33.44 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 122.315 1.055 . . . . 0.0 111.407 174.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.468 ' HA ' ' CD1' ' A' ' 8' ' ' PHE . 1.9 p30 -81.03 100.71 9.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 124.247 1.975 . . . . 0.0 113.731 177.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.435 HD22 ' CD ' ' A' ' 41' ' ' LYS . 8.8 mt -65.89 -27.84 68.5 Favored 'General case' 0 C--O 1.218 -0.557 0 O-C-N 118.733 -2.479 . . . . 0.0 111.723 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.1 t . . . . . 0 N--CA 1.466 0.348 0 C-N-CA 124.3 1.04 . . . . 0.0 112.888 177.149 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.435 ' CD ' HD22 ' A' ' 34' ' ' LEU . 74.3 mttt . . . . . 0 C--O 1.222 -0.349 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.41 -34.22 33.71 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.524 0.583 . . . . 0.0 113.958 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.6 mmtt -85.68 15.28 4.82 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.198 1.399 . . . . 0.0 113.024 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.72 36.89 93.93 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 123.735 0.683 . . . . 0.0 112.243 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.82 177.49 21.88 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 121.876 0.709 . . . . 0.0 112.192 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -142.28 152.77 43.33 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.7 1.238 . . . . 0.0 111.819 178.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.9 t -66.49 128.77 37.5 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 111.948 175.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -125.23 148.0 59.23 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 122.284 1.04 . . . . 0.0 111.793 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.04 156.23 65.86 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.287 1.992 . . . . 0.0 111.147 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.44 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 9.7 mt -65.16 -18.07 65.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 176.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -85.4 -9.6 57.33 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.402 0.681 . . . . 0.0 112.09 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -93.36 131.21 38.73 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 120.871 -1.143 . . . . 0.0 110.052 176.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -78.8 121.71 25.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.27 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.4 t -168.34 174.56 6.93 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 123.916 0.886 . . . . 0.0 110.055 176.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -92.51 124.45 36.55 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.458 1.103 . . . . 0.0 111.127 173.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -125.91 131.8 52.25 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 125.686 1.594 . . . . 0.0 110.687 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 58' ' ' GLN . 12.3 tp -91.21 135.22 33.94 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.562 -0.711 . . . . 0.0 109.808 177.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.439 ' N ' HD12 ' A' ' 57' ' ' LEU . 7.0 pt20 -51.0 -40.25 57.7 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 175.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.01 64.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.142 0.977 . . . . 0.0 111.863 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.402 ' OE1' HD23 ' A' ' 57' ' ' LEU . 1.3 mp0 -95.93 -33.53 12.15 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.67 1.188 . . . . 0.0 110.428 -178.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.1 m -53.53 -30.6 42.46 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.185 0.994 . . . . 0.0 111.37 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.87 63.42 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.82 0.848 . . . . 0.0 112.937 174.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.5 t -58.01 -58.05 10.11 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.705 0.802 . . . . 0.0 111.378 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 97.9 m -71.69 -47.25 55.42 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.964 0.412 . . . . 0.0 111.559 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -150.51 18.51 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-O 123.36 1.533 . . . . 0.0 112.38 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -78.29 145.52 35.33 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 120.249 -1.736 . . . . 0.0 111.354 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.71 0.63 85.16 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 119.31 -0.717 . . . . 0.0 113.544 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -149.21 149.31 30.77 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.219 1.007 . . . . 0.0 110.713 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.44 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -132.09 138.86 48.3 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.472 0.709 . . . . 0.0 110.29 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.5 t -77.59 131.45 37.83 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.877 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.515 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.1 OUTLIER -120.25 150.62 40.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 119.676 1.125 . . . . 0.0 110.386 177.333 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.41 141.31 46.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 123.555 0.742 . . . . 0.0 110.308 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.515 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 11.7 m95 . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 122.023 0.916 . . . . 0.0 111.975 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 . . . . . 0 N--CA 1.468 0.433 0 CA-C-O 120.473 0.178 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.7 m -51.97 -55.97 17.12 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 121.136 -0.977 . . . . 0.0 111.136 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.6 p -56.93 -34.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 175.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.0 t -63.02 -27.17 69.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.068 1.347 . . . . 0.0 112.409 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.407 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 1.0 OUTLIER -96.74 -9.7 28.39 Favored 'General case' 0 C--N 1.34 0.176 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 171.299 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 85.89 29.66 25.49 Favored Glycine 0 CA--C 1.525 0.668 0 CA-C-O 117.826 -1.541 . . . . 0.0 112.989 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.407 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 66.5 m-85 -88.81 168.88 12.09 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.065 1.433 . . . . 0.0 113.194 175.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.42 129.79 8.64 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.494 1.045 . . . . 0.0 111.623 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.2 m -77.16 132.4 38.78 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.053 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.3 mt -142.59 162.68 43.2 Favored Pre-proline 0 N--CA 1.469 0.513 0 O-C-N 124.327 1.017 . . . . 0.0 111.152 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -70.48 140.92 41.06 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.536 2.157 . . . . 0.0 111.127 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -55.4 -20.86 13.39 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.1 t -67.63 -48.47 66.64 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.902 1.281 . . . . 0.0 113.444 169.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -73.58 -44.68 56.7 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-O 123.173 1.463 . . . . 0.0 112.18 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.8 t -79.34 116.63 61.94 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 119.851 -1.78 . . . . 0.0 112.874 -178.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.67 154.12 71.08 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.012 1.808 . . . . 0.0 111.918 -177.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -28.4 22.22 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -81.68 -18.96 42.67 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.624 1.97 . . . . 0.0 113.114 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.71 -21.72 17.42 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 116.206 -1.854 . . . . 0.0 113.098 172.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -54.91 111.78 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.192 1.36 . . . . 0.0 111.335 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.589 HD21 ' HB2' ' A' ' 33' ' ' ASP . 2.6 mt -94.8 174.61 7.02 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.713 0.768 . . . . 0.0 109.921 -178.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.2 m -118.24 25.49 10.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.921 1.288 . . . . 0.0 112.675 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -66.03 -20.81 66.3 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-O 117.701 -1.143 . . . . 0.0 112.151 174.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.9 73.25 0.45 Allowed Glycine 0 N--CA 1.476 1.308 0 CA-C-N 121.107 1.776 . . . . 0.0 112.667 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -177.38 29.02 0.07 OUTLIER Glycine 0 C--O 1.23 -0.132 0 O-C-N 120.674 -1.486 . . . . 0.0 113.266 -174.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.6 m -129.58 157.75 41.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.631 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.0 t -44.19 -47.28 9.17 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.067 1.479 . . . . 0.0 112.664 -177.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -131.49 -59.3 0.97 Allowed 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.322 1.449 . . . . 0.0 110.21 177.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.4 p -140.33 153.3 21.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 122.676 1.227 . . . . 0.0 110.919 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.414 ' SG ' HD12 ' A' ' 22' ' ' LEU . 2.4 t -93.78 137.02 33.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.101 174.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -113.17 140.09 48.21 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 122.509 1.147 . . . . 0.0 112.523 176.113 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.589 ' HB2' HD21 ' A' ' 22' ' ' LEU . 11.8 t0 -81.09 101.25 9.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.79 -1.095 . . . . 0.0 111.523 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -62.64 -37.92 88.24 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.644 -1.17 . . . . 0.0 112.127 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.474 0.767 0 C-N-CA 125.361 1.464 . . . . 0.0 112.414 178.138 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt . . . . . 0 C--O 1.225 -0.191 0 CA-C-O 118.058 -0.972 . . . . 0.0 112.76 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.35 54.84 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.98 1.276 . . . . 0.0 114.216 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -81.78 12.29 4.11 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.766 1.626 . . . . 0.0 114.28 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.5 22.26 76.44 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.785 1.183 . . . . 0.0 114.49 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.96 -175.81 30.63 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.506 1.051 . . . . 0.0 112.626 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.13 149.65 29.73 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.227 1.011 . . . . 0.0 111.504 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.29 130.59 47.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 120.998 -1.064 . . . . 0.0 112.442 172.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -128.46 151.89 77.41 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.75 0.82 . . . . 0.0 111.435 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.03 153.63 67.47 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.506 2.137 . . . . 0.0 110.616 176.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.98 -20.46 62.44 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -73.93 -18.92 60.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.511 1.524 . . . . 0.0 113.399 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -86.72 129.57 34.82 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 120.512 -1.367 . . . . 0.0 109.834 174.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -79.64 125.37 29.53 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.94 170.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.36 174.15 3.96 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.4 1.08 . . . . 0.0 110.703 175.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -86.54 124.26 32.64 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.208 1.003 . . . . 0.0 110.451 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -124.33 139.03 54.29 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.097 1.498 . . . . 0.0 112.09 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.89 148.98 22.83 Favored 'General case' 0 C--O 1.22 -0.485 0 O-C-N 120.801 -1.187 . . . . 0.0 109.645 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -64.15 -40.05 95.32 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.399 -0.813 . . . . 0.0 112.369 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.79 -32.55 59.93 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.61 -36.73 28.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.612 -0.68 . . . . 0.0 112.72 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.2 m -54.38 -29.42 48.57 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.116 1.367 . . . . 0.0 112.26 175.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.14 86.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 117.963 -1.018 . . . . 0.0 112.94 174.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t -44.13 -58.04 3.07 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.791 2.037 . . . . 0.0 112.074 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -80.36 -56.2 4.36 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.878 172.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 42.57 -147.54 0.64 Allowed Glycine 0 C--N 1.35 1.326 0 C-N-CA 127.247 2.356 . . . . 0.0 112.353 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt 49.09 46.47 22.61 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 119.837 1.819 . . . . 0.0 114.277 174.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.77 23.0 62.91 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 121.266 -0.896 . . . . 0.0 114.201 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -132.24 159.47 38.96 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 126.379 1.872 . . . . 0.0 110.086 177.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -137.98 124.33 20.6 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 126.439 1.895 . . . . 0.0 109.835 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.53 125.94 28.24 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.517 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.1 m -120.08 137.79 53.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 120.055 1.298 . . . . 0.0 111.798 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.1 p -106.79 144.52 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 122.12 0.962 . . . . 0.0 110.395 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.6 m95 . . . . . 0 CA--C 1.539 0.536 0 C-N-CA 124.82 1.248 . . . . 0.0 111.956 172.142 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.47 0.575 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.2 m -47.86 -54.95 10.94 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.07 -1.019 . . . . 0.0 111.863 173.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 p -57.41 -34.09 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.065 1.346 . . . . 0.0 112.795 176.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 t -64.5 -29.48 70.52 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.33 1.452 . . . . 0.0 111.73 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.411 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 24.5 mmmt -94.37 -3.55 50.12 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 172.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 78.01 35.26 35.31 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-N 118.797 0.726 . . . . 0.0 113.073 -176.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.483 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 39.0 m-85 -99.19 166.3 11.3 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.949 1.3 . . . . 0.0 112.466 173.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 143.62 17.53 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.255 0.931 . . . . 0.0 111.308 179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.82 131.38 35.26 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.724 -0.868 . . . . 0.0 110.861 174.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -141.51 156.84 66.61 Favored Pre-proline 0 N--CA 1.471 0.589 0 C-N-CA 123.536 0.734 . . . . 0.0 111.144 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.69 139.28 62.61 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.731 2.287 . . . . 0.0 110.727 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -53.28 -18.84 2.68 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 175.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -71.31 -47.11 58.7 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.415 1.886 . . . . 0.0 111.902 170.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.69 -36.07 44.16 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.573 1.149 . . . . 0.0 111.993 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.7 t -88.17 112.03 46.86 Favored Pre-proline 0 C--O 1.246 0.869 0 C-N-CA 123.878 0.871 . . . . 0.0 111.668 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.91 153.96 64.79 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 123.033 2.489 . . . . 0.0 110.937 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -50.47 -35.07 27.34 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.026 -1.046 . . . . 0.0 113.798 175.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -71.1 -20.76 62.3 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.341 1.056 . . . . 0.0 113.378 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.85 -19.21 16.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.372 1.869 . . . . 0.0 114.656 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HD3' HG21 ' A' ' 30' ' ' VAL . 71.6 mtt180 -61.17 115.54 3.87 Favored 'General case' 0 CA--C 1.522 -0.104 0 O-C-N 121.25 -0.906 . . . . 0.0 109.982 173.153 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.638 HD11 ' HB3' ' A' ' 33' ' ' ASP . 11.9 mt -100.64 166.78 10.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.721 0.772 . . . . 0.0 110.846 178.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.32 27.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.811 1.244 . . . . 0.0 112.573 177.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.489 ' CE2' HD13 ' A' ' 22' ' ' LEU . 68.1 m-85 -65.46 -22.47 66.75 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.117 -0.989 . . . . 0.0 112.666 175.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.61 76.95 0.2 Allowed Glycine 0 CA--C 1.532 1.096 0 CA-C-N 120.025 1.284 . . . . 0.0 113.696 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -175.25 31.63 0.09 OUTLIER Glycine 0 N--CA 1.464 0.501 0 O-C-N 121.141 -1.211 . . . . 0.0 113.324 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.7 m -136.98 148.24 46.79 Favored 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 124.198 0.999 . . . . 0.0 111.272 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.9 m -58.65 -41.92 87.16 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.799 0.84 . . . . 0.0 112.053 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 p -109.55 -75.19 0.63 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.401 1.08 . . . . 0.0 109.069 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' A' ' 21' ' ' ARG . 13.8 p -147.18 149.11 15.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 126.337 1.855 . . . . 0.0 109.687 177.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.9 t -76.98 128.13 33.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.636 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -114.36 131.45 56.55 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.403 1.081 . . . . 0.0 111.25 177.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.638 ' HB3' HD11 ' A' ' 22' ' ' LEU . 1.5 p30 -84.58 97.7 9.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 124.186 1.946 . . . . 0.0 113.219 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.469 HD22 ' HB3' ' A' ' 41' ' ' LYS . 16.0 mt -54.67 -35.53 63.63 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.161 178.647 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.1 m . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.583 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.469 ' HB3' HD22 ' A' ' 34' ' ' LEU . 54.1 mttt . . . . . 0 N--CA 1.466 0.352 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.28 -41.88 87.72 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.961 0.791 . . . . 0.0 113.765 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -83.92 16.55 2.77 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.644 1.578 . . . . 0.0 114.069 174.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.19 42.19 76.92 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.465 1.031 . . . . 0.0 114.499 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -123.08 175.06 16.56 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.043 1.782 . . . . 0.0 113.925 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -150.66 149.03 29.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.993 1.317 . . . . 0.0 111.048 -175.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -65.84 123.0 18.6 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.119 -0.988 . . . . 0.0 111.483 173.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -127.34 148.22 65.36 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 124.636 1.175 . . . . 0.0 111.22 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -68.02 157.07 63.4 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.458 2.105 . . . . 0.0 111.125 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -62.07 -21.89 65.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -75.22 -13.07 60.41 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.255 2.222 . . . . 0.0 113.008 173.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.51 126.76 35.41 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 119.749 -1.845 . . . . 0.0 110.269 174.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -78.29 117.6 19.7 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.798 0.839 . . . . 0.0 110.076 171.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.2 t -163.06 176.87 9.64 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.333 1.453 . . . . 0.0 109.553 171.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -91.42 106.85 18.79 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 125.505 1.522 . . . . 0.0 110.147 172.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -101.3 141.94 33.44 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.037 0.922 . . . . 0.0 111.196 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.483 HD23 ' HG2' ' A' ' 60' ' ' GLU . 16.7 tp -89.98 134.84 34.0 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.071 -1.018 . . . . 0.0 109.526 170.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 pm0 -48.85 -44.93 40.08 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.079 1.352 . . . . 0.0 112.381 172.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.35 -23.64 64.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.715 1.206 . . . . 0.0 112.752 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.483 ' HG2' HD23 ' A' ' 57' ' ' LEU . 38.2 mm-40 -90.4 -39.02 12.92 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.947 1.299 . . . . 0.0 112.935 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.1 p -54.21 -28.5 41.29 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.936 -1.103 . . . . 0.0 112.603 173.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.78 -36.42 69.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.462 1.505 . . . . 0.0 113.157 175.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.3 m -70.63 -48.52 54.58 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.603 1.161 . . . . 0.0 113.281 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 17.3 m -62.29 -40.03 94.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.14 -176.35 25.63 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 122.616 1.12 . . . . 0.0 112.859 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -63.95 143.24 58.01 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.988 -1.301 . . . . 0.0 111.571 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.06 10.62 85.98 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 119.133 -0.815 . . . . 0.0 114.385 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -137.15 160.59 38.55 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.624 1.57 . . . . 0.0 110.694 177.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -137.83 117.32 12.91 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.312 1.845 . . . . 0.0 110.543 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.0 t -74.73 97.59 3.27 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.815 -0.553 . . . . 0.0 110.967 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -77.31 161.67 27.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.605 1.562 . . . . 0.0 110.821 173.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.7 t -123.67 134.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.035 1.334 . . . . 0.0 109.745 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 24.0 m95 . . . . . 0 N--CA 1.463 0.221 0 C-N-CA 124.353 1.061 . . . . 0.0 112.065 178.405 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 . . . . . 0 C--O 1.22 -0.475 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.4 m -47.8 -55.92 8.58 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.658 -0.651 . . . . 0.0 111.284 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.5 p -58.91 -31.06 44.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.017 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.1 t -63.72 -30.12 71.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.727 0.811 . . . . 0.0 110.544 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.528 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 27.0 mmtt -96.18 -9.23 31.03 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.26 29.17 25.79 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 119.195 -0.78 . . . . 0.0 111.906 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.528 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 61.8 m-85 -89.75 168.74 11.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 118.331 1.065 . . . . 0.0 111.715 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.66 126.66 6.92 Favored Glycine 0 CA--C 1.519 0.306 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.546 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.0 m -75.78 139.43 41.8 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.95 -0.735 . . . . 0.0 111.076 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.5 mt -154.99 155.0 29.78 Favored Pre-proline 0 C--O 1.206 -1.202 0 O-C-N 124.19 0.931 . . . . 0.0 112.051 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.532 ' HA ' HG21 ' A' ' 29' ' ' THR . 51.0 Cg_endo -68.06 133.95 30.4 Favored 'Trans proline' 0 CA--C 1.506 -0.916 0 C-N-CA 123.98 3.12 . . . . 0.0 111.116 179.402 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.406 ' HG3' ' CG1' ' A' ' 30' ' ' VAL . 63.2 mt-30 -47.34 -27.83 1.77 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 123.191 0.596 . . . . 0.0 111.397 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.6 p -59.73 -47.43 85.7 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -83.12 -30.89 27.55 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.338 0.59 . . . . 0.0 112.46 177.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 20' ' ' ALA . 17.7 t -93.19 126.63 50.1 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 121.71 -0.619 . . . . 0.0 111.694 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.512 ' HG2' ' HB2' ' A' ' 20' ' ' ALA . 50.0 Cg_endo -67.49 153.01 77.81 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.855 2.37 . . . . 0.0 112.265 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -52.91 -35.08 57.72 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -73.23 -16.34 61.41 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 123.927 0.891 . . . . 0.0 111.13 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.512 ' HB2' ' HG2' ' A' ' 17' ' ' PRO . . . -95.29 -30.26 14.05 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 124.072 0.858 . . . . 0.0 113.052 177.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -54.27 113.01 1.1 Allowed 'General case' 0 C--N 1.334 -0.069 0 O-C-N 121.584 -0.698 . . . . 0.0 110.07 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.551 HD13 ' CE2' ' A' ' 24' ' ' TYR . 13.0 mt -96.33 177.92 5.54 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.776 0.798 . . . . 0.0 110.2 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.8 p -122.38 34.58 5.11 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.385 0.674 . . . . 0.0 111.391 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.551 ' CE2' HD13 ' A' ' 22' ' ' LEU . 59.1 m-85 -73.82 -16.87 61.13 Favored 'General case' 0 C--O 1.203 -1.379 0 O-C-N 122.092 -0.38 . . . . 0.0 110.84 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.6 80.99 0.07 OUTLIER Glycine 0 C--O 1.219 -0.839 0 CA-C-O 122.439 1.021 . . . . 0.0 111.905 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.2 26.07 0.04 OUTLIER Glycine 0 C--O 1.223 -0.538 0 O-C-N 120.796 -1.414 . . . . 0.0 112.795 -179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 56.2 m -124.44 156.98 36.27 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 117.02 0.41 . . . . 0.0 111.533 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -48.9 -44.73 40.43 Favored 'General case' 0 C--O 1.223 -0.338 0 O-C-N 123.923 0.765 . . . . 0.0 111.122 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.572 HG23 ' H ' ' A' ' 30' ' ' VAL . 1.2 t -132.34 -60.3 0.9 Allowed 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.601 0.76 . . . . 0.0 110.965 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.572 ' H ' HG23 ' A' ' 29' ' ' THR . 13.9 p -145.35 140.29 22.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 CA-C-O 121.847 0.832 . . . . 0.0 110.988 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 1.3 t -82.63 140.57 33.1 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.291 -0.88 . . . . 0.0 111.969 176.09 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -116.19 130.07 56.61 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.835 1.302 . . . . 0.0 110.742 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.16 106.39 7.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 123.128 1.442 . . . . 0.0 112.146 177.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mt -64.94 -37.7 88.53 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 119.271 -2.143 . . . . 0.0 110.182 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 CA--C 1.528 0.123 0 O-C-N 121.803 -0.56 . . . . 0.0 112.05 178.844 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt . . . . . 0 C--O 1.222 -0.381 0 CA-C-O 121.516 0.674 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -69.42 -36.19 77.3 Favored Glycine 0 C--N 1.336 0.544 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.0 mttt -78.61 12.67 1.94 Allowed 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.58 42.08 14.63 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.788 -0.525 . . . . 0.0 111.788 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -115.65 169.39 12.91 Favored Glycine 0 CA--C 1.518 0.244 0 CA-C-N 117.033 0.417 . . . . 0.0 112.774 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -149.74 155.91 40.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.833 0.825 . . . . 0.0 112.127 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 t -73.71 130.8 40.73 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.102 -0.999 . . . . 0.0 112.456 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -135.76 148.44 65.35 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 121.598 0.713 . . . . 0.0 112.063 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.18 159.22 54.08 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.506 2.138 . . . . 0.0 111.508 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.464 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 14.4 mt -60.96 -15.84 35.92 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.55 -10.63 57.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.058 0.543 . . . . 0.0 111.455 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.46 129.15 41.34 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 121.775 0.798 . . . . 0.0 109.877 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -80.45 120.51 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.715 176.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -172.83 170.53 4.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.456 0.646 . . . . 0.0 111.169 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 tttt -83.08 111.13 18.6 Favored 'General case' 0 CA--C 1.522 -0.121 0 O-C-N 121.859 -0.525 . . . . 0.0 110.456 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -117.87 128.96 55.34 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.746 0.784 . . . . 0.0 111.293 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.607 HD12 ' HG3' ' A' ' 60' ' ' GLU . 15.7 mt -84.82 156.39 21.35 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.589 -0.694 . . . . 0.0 110.636 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -69.61 -33.95 73.39 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.351 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.47 -31.05 33.17 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 120.82 0.343 . . . . 0.0 111.813 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.607 ' HG3' HD12 ' A' ' 57' ' ' LEU . 8.7 mm-40 -80.45 -30.98 37.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.983 0.42 . . . . 0.0 111.007 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.406 ' HB2' ' HD3' ' A' ' 69' ' ' LYS . 93.6 p -55.31 -37.87 67.93 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.628 -0.67 . . . . 0.0 111.588 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.96 -36.69 72.92 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 123.525 0.516 . . . . 0.0 112.074 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.0 t -54.42 -54.37 41.69 Favored 'General case' 0 C--N 1.334 -0.108 0 O-C-N 123.411 0.444 . . . . 0.0 111.474 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 8.8 m -57.06 -49.97 74.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.377 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 116.21 175.6 17.92 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-O 122.496 1.053 . . . . 0.0 112.067 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -61.4 129.24 40.25 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.329 -1.101 . . . . 0.0 110.436 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.36 6.58 70.79 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 113.483 -179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -141.93 162.5 35.31 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.395 0.617 . . . . 0.0 110.951 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.464 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 64.5 mmtt -138.49 138.75 38.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 122.133 0.968 . . . . 0.0 111.93 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -84.49 106.04 15.76 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.583 -0.698 . . . . 0.0 110.672 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.33 156.17 21.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.674 0.75 . . . . 0.0 111.795 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.12 144.65 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 C-N-CA 123.226 0.61 . . . . 0.0 111.18 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 57.9 m95 . . . . . 0 C--N 1.326 -0.442 0 CA-C-O 121.541 0.686 . . . . 0.0 111.853 176.374 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.472 0.668 0 CA-C-O 120.582 0.229 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.2 m -53.67 -48.24 69.65 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.513 -1.367 . . . . 0.0 111.829 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -56.43 -27.1 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.552 1.141 . . . . 0.0 113.187 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 t -66.8 -35.19 79.49 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.875 1.27 . . . . 0.0 111.287 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.455 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 3.6 mmmm -96.9 -7.65 32.79 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 174.024 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.25 44.35 7.05 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.203 0.906 . . . . 0.0 112.396 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.455 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 35.6 m-85 -108.65 163.31 13.36 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.091 1.356 . . . . 0.0 112.169 176.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.77 145.29 18.4 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.276 0.941 . . . . 0.0 111.382 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.5 m -83.13 136.3 34.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.7 -0.883 . . . . 0.0 112.025 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.1 mt -148.6 155.83 41.8 Favored Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.738 0.815 . . . . 0.0 111.857 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.53 142.69 79.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.431 2.087 . . . . 0.0 110.884 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -52.54 -21.18 3.54 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 175.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 t -74.17 -46.96 38.92 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.102 1.761 . . . . 0.0 112.868 170.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -68.37 -50.27 54.28 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.276 1.03 . . . . 0.0 110.775 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.53 118.21 70.55 Favored Pre-proline 0 C--O 1.246 0.88 0 O-C-N 121.566 -0.709 . . . . 0.0 111.535 -174.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.02 151.06 86.67 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.793 2.329 . . . . 0.0 110.847 -177.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -52.33 -24.32 7.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -79.55 -28.73 41.21 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.367 1.467 . . . . 0.0 113.989 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -24.47 22.4 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.562 1.145 . . . . 0.0 111.206 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HG2' HG21 ' A' ' 30' ' ' VAL . 97.0 mtt180 -48.32 117.99 2.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.412 0.685 . . . . 0.0 110.885 174.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.436 HD21 ' HB2' ' A' ' 33' ' ' ASP . 19.5 mt -99.77 172.08 7.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.923 0.868 . . . . 0.0 110.455 179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.6 p -100.65 11.29 39.83 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.848 1.659 . . . . 0.0 112.985 177.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.418 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 54.4 m-85 -77.44 -11.74 59.88 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.133 -0.98 . . . . 0.0 112.2 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.72 -106.23 0.57 Allowed Glycine 0 C--O 1.216 -1.0 0 CA-C-O 116.771 -2.127 . . . . 0.0 110.176 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 39.48 28.04 0.1 Allowed Glycine 0 N--CA 1.474 1.21 0 C-N-CA 127.342 2.401 . . . . 0.0 115.419 175.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.0 m -145.67 146.71 31.4 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.441 1.496 . . . . 0.0 108.972 -169.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 m -68.66 -22.71 64.38 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 p -127.0 -75.86 0.58 Allowed 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 125.943 1.697 . . . . 0.0 110.659 -175.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.454 HG21 ' HG2' ' A' ' 21' ' ' ARG . 7.1 p -148.58 150.44 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 O-C-N 121.312 -0.868 . . . . 0.0 110.863 174.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 t -78.77 129.44 34.64 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 121.516 -0.74 . . . . 0.0 110.354 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.83 140.21 46.67 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.245 1.022 . . . . 0.0 112.964 177.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.436 ' HB2' HD21 ' A' ' 22' ' ' LEU . 14.4 t0 -88.98 104.31 16.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.262 1.029 . . . . 0.0 110.987 -178.551 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.508 HD22 ' HB3' ' A' ' 41' ' ' LYS . 53.7 mt -58.37 -33.11 69.21 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.022 175.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 125.122 1.369 . . . . 0.0 111.868 178.065 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.508 ' HB3' HD22 ' A' ' 34' ' ' LEU . 39.0 mmtt . . . . . 0 C--O 1.223 -0.291 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.194 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.99 -42.85 54.94 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 124.157 0.884 . . . . 0.0 113.601 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.568 ' HE3' ' OE1' ' A' ' 60' ' ' GLU . 7.6 mtmp? -78.99 15.44 1.11 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.033 1.733 . . . . 0.0 113.928 173.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.11 32.67 83.21 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.251 1.881 . . . . 0.0 114.42 -176.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -97.14 170.99 26.52 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-O 122.779 1.211 . . . . 0.0 113.417 177.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.2 tt0 -138.93 150.07 45.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.148 1.379 . . . . 0.0 111.756 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 90.5 m -71.87 120.25 17.2 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 120.754 -1.216 . . . . 0.0 111.192 173.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -110.52 150.69 42.02 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.307 1.043 . . . . 0.0 110.661 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.04 152.45 76.63 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.635 2.224 . . . . 0.0 111.543 176.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.663 HD11 ' HA2' ' A' ' 67' ' ' GLY . 39.6 mt -57.59 -24.52 56.77 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -73.76 -19.58 60.74 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.163 1.785 . . . . 0.0 112.862 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -89.18 134.82 33.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 123.08 1.419 . . . . 0.0 110.744 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -96.54 120.73 37.38 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 125.069 1.348 . . . . 0.0 109.439 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.6 p -166.76 170.67 12.19 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.174 1.39 . . . . 0.0 109.953 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -73.62 108.01 6.21 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.624 1.17 . . . . 0.0 109.863 175.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.91 145.58 42.05 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.075 0.95 . . . . 0.0 109.783 174.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.02 139.75 32.56 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.176 0.59 . . . . 0.0 110.326 173.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -63.14 -42.08 99.4 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.599 -0.688 . . . . 0.0 112.525 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.05 76.98 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.592 -0.692 . . . . 0.0 111.991 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.568 ' OE1' ' HE3' ' A' ' 43' ' ' LYS . 3.8 tp10 -85.7 -33.79 21.43 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.395 1.078 . . . . 0.0 113.482 -177.262 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.7 p -53.11 -34.2 55.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.693 1.597 . . . . 0.0 112.377 173.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.61 -36.18 71.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.38 1.072 . . . . 0.0 111.844 176.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -48.25 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.327 1.051 . . . . 0.0 112.473 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 67.6 m -60.84 -41.97 96.85 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 122.448 0.299 . . . . 0.0 111.693 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 113.37 174.24 18.89 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 122.679 1.155 . . . . 0.0 112.732 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -64.53 129.12 38.65 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.707 0.803 . . . . 0.0 109.76 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.663 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 88.36 13.99 62.69 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-O 117.871 -1.516 . . . . 0.0 113.42 -177.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -139.57 156.36 46.93 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.663 1.585 . . . . 0.0 110.639 176.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -127.04 119.0 25.55 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.253 1.821 . . . . 0.0 110.118 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.2 t -76.04 104.95 6.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.415 -0.803 . . . . 0.0 111.408 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 60.9 m -101.23 161.19 13.79 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.712 0.768 . . . . 0.0 112.058 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.8 m -116.22 145.07 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.604 0.762 . . . . 0.0 110.993 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 71.6 m95 . . . . . 0 N--CA 1.461 0.094 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.402 177.395 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 120.555 0.217 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 97.0 m -51.49 -63.18 1.22 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.275 1.03 . . . . 0.0 111.421 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.6 p -56.59 -34.81 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 112.773 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.5 t -62.64 -26.05 68.43 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.949 1.3 . . . . 0.0 112.422 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 2.6 mmpt? -99.25 -7.18 26.79 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 171.3 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.38 28.74 35.33 Favored Glycine 0 CA--C 1.535 1.315 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.377 -175.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -90.54 160.84 15.76 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.672 1.736 . . . . 0.0 113.649 175.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.42 123.83 7.7 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 125.771 1.653 . . . . 0.0 111.797 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -73.85 131.11 41.16 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 121.333 -1.098 . . . . 0.0 111.283 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 70.6 mt -142.19 164.19 35.11 Favored Pre-proline 0 N--CA 1.472 0.649 0 C-N-CA 123.021 0.528 . . . . 0.0 110.583 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.42 141.49 35.19 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.161 1.907 . . . . 0.0 111.656 171.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -51.02 -15.57 0.33 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.864 1.666 . . . . 0.0 115.181 173.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 t -78.27 -39.54 39.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.953 2.101 . . . . 0.0 113.021 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -86.25 -37.1 18.95 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.69 1.596 . . . . 0.0 110.924 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.3 t -92.49 116.33 66.31 Favored Pre-proline 0 C--O 1.245 0.856 0 C-N-CA 124.431 1.092 . . . . 0.0 111.921 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.76 151.22 86.49 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.541 2.161 . . . . 0.0 111.672 -175.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -53.8 -28.71 36.75 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -72.89 -19.7 61.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.697 1.199 . . . . 0.0 113.658 176.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -102.65 -16.08 16.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 128.048 2.539 . . . . 0.0 114.276 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.519 ' HG2' HG21 ' A' ' 30' ' ' VAL . 89.5 mtt180 -59.74 105.25 0.36 Allowed 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.254 -0.903 . . . . 0.0 112.2 171.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.617 HD11 ' HB3' ' A' ' 33' ' ' ASP . 10.7 mt -93.6 163.32 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 111.846 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 p -103.71 22.39 14.5 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.11 1.764 . . . . 0.0 114.407 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.551 ' CE2' HD13 ' A' ' 22' ' ' LEU . 85.2 m-85 -67.79 3.51 1.44 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.964 1.706 . . . . 0.0 115.452 175.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 38.98 64.33 0.93 Allowed Glycine 0 N--CA 1.475 1.261 0 C-N-CA 126.917 2.199 . . . . 0.0 114.876 171.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -165.22 28.17 0.2 Allowed Glycine 0 C--O 1.226 -0.395 0 CA-C-O 118.738 -1.035 . . . . 0.0 113.472 -173.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.6 m -130.42 161.91 30.31 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.6 0.76 . . . . 0.0 112.422 177.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -53.54 -36.34 61.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.508 1.123 . . . . 0.0 113.549 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.29 -50.29 0.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.543 1.137 . . . . 0.0 111.074 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.519 HG21 ' HG2' ' A' ' 21' ' ' ARG . 11.9 p -147.24 149.29 15.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 122.07 0.938 . . . . 0.0 111.432 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.412 ' HB3' ' HB2' ' A' ' 22' ' ' LEU . 4.2 t -89.7 137.66 32.14 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 124.355 1.062 . . . . 0.0 108.8 172.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.16 133.18 56.27 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.105 0.962 . . . . 0.0 111.225 177.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.617 ' HB3' HD11 ' A' ' 22' ' ' LEU . 2.7 p30 -82.36 90.01 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 123.97 1.843 . . . . 0.0 112.679 -177.333 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -50.31 -33.66 20.91 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.123 1.156 . . . . 0.0 114.123 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 177.823 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.455 ' HE2' ' OE2' ' A' ' 46' ' ' GLU . 34.1 mmtp . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.91 -29.77 62.4 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.116 0.865 . . . . 0.0 115.011 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -87.51 8.22 25.92 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.14 32.78 30.93 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.341 0.972 . . . . 0.0 113.422 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.8 164.03 28.65 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 124.282 0.944 . . . . 0.0 113.332 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.455 ' OE2' ' HE2' ' A' ' 41' ' ' LYS . 8.6 tp10 -152.13 151.8 31.51 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.574 1.15 . . . . 0.0 112.539 178.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 36.4 m -70.19 121.46 17.6 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.874 -1.141 . . . . 0.0 111.369 174.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -121.89 148.25 50.72 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.977 0.911 . . . . 0.0 111.784 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -69.29 155.44 67.48 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.456 2.104 . . . . 0.0 110.697 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.7 mt -60.59 -21.31 62.49 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -74.17 -20.53 60.18 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 128.258 2.623 . . . . 0.0 112.86 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -88.62 119.89 29.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.298 -1.501 . . . . 0.0 110.638 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -63.04 117.67 6.78 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.136 0.574 . . . . 0.0 111.09 168.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.9 t -155.66 -173.1 4.39 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.305 1.042 . . . . 0.0 110.055 166.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -96.84 108.1 20.71 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.201 1.8 . . . . 0.0 110.098 167.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -107.87 147.67 30.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.66 120.36 42.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.402 1.481 . . . . 0.0 110.255 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.406 ' H ' ' NE2' ' A' ' 58' ' ' GLN . 5.7 mp0 -55.36 -34.79 64.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.609 0.764 . . . . 0.0 111.685 -176.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.77 -39.4 65.35 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.693 2.397 . . . . 0.0 113.956 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -105.85 -13.73 15.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.143 1.377 . . . . 0.0 112.386 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -55.83 -37.57 68.87 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.14 -1.6 . . . . 0.0 112.108 174.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.83 -32.0 71.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.54 1.536 . . . . 0.0 113.417 173.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -63.94 -48.96 74.48 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.268 1.427 . . . . 0.0 111.971 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.9 t -67.98 -29.93 69.08 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 175.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.73 176.62 25.89 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-O 122.865 1.258 . . . . 0.0 113.672 176.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -64.68 130.76 44.79 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.841 -1.388 . . . . 0.0 111.822 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.54 4.79 60.56 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.108 0.861 . . . . 0.0 114.054 -178.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -132.82 161.23 34.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.695 1.598 . . . . 0.0 110.594 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -138.17 120.18 15.51 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.046 1.738 . . . . 0.0 110.788 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.2 t -73.25 92.17 1.75 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 122.778 0.431 . . . . 0.0 110.579 177.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.4 t -80.35 160.22 25.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.936 1.694 . . . . 0.0 110.667 177.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.8 p -133.53 143.12 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.134 0.973 . . . . 0.0 111.0 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 36.1 m95 . . . . . 0 CA--C 1.537 0.462 0 C-N-CA 124.32 1.048 . . . . 0.0 110.335 177.936 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 . . . . . 0 N--CA 1.474 0.752 0 CA-C-O 121.3 0.571 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.599 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 73.9 m -51.32 -59.26 4.41 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 120.814 -1.179 . . . . 0.0 111.099 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.79 -32.76 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -63.11 -31.83 73.07 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.602 1.161 . . . . 0.0 110.994 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -95.09 -11.49 28.17 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.74 -1.124 . . . . 0.0 113.569 174.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.19 33.91 22.04 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 124.157 0.911 . . . . 0.0 112.397 -177.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -80.35 169.17 18.09 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 118.74 1.27 . . . . 0.0 112.342 175.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.851 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -114.84 117.58 4.08 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 123.648 0.642 . . . . 0.0 111.544 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.0 m -72.16 131.92 43.45 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.259 175.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 79.8 mt -147.87 156.39 44.32 Favored Pre-proline 0 C--O 1.218 -0.597 0 O-C-N 124.309 1.006 . . . . 0.0 111.224 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.469 ' HA ' HG21 ' A' ' 29' ' ' THR . 56.1 Cg_endo -66.3 139.66 55.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.089 2.526 . . . . 0.0 111.247 175.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -52.22 -20.68 2.78 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.1 t -66.74 -48.13 70.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.948 1.299 . . . . 0.0 112.611 170.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.44 -38.1 42.06 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.157 0.983 . . . . 0.0 111.361 177.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -87.61 125.86 63.81 Favored Pre-proline 0 CA--C 1.541 0.623 0 O-C-N 120.866 -1.146 . . . . 0.0 111.918 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -63.25 146.36 93.81 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.997 2.465 . . . . 0.0 110.691 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -52.2 -20.38 2.58 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.32 -35.76 30.58 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.867 1.667 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.44 ' HB1' ' OD1' ' A' ' 33' ' ' ASP . . . -83.01 -26.47 31.2 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 176.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -44.84 110.65 0.24 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.243 1.017 . . . . 0.0 111.429 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 33' ' ' ASP . 9.8 mt -95.72 175.15 6.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.475 1.131 . . . . 0.0 110.221 -178.277 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.1 p -127.13 29.23 5.63 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.361 1.064 . . . . 0.0 112.429 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.599 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 9.5 m-85 -71.5 -15.94 62.33 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 121.409 -0.807 . . . . 0.0 111.207 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.14 82.8 0.07 OUTLIER Glycine 0 CA--C 1.53 0.978 0 CA-C-O 124.395 2.108 . . . . 0.0 112.095 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 174.25 32.71 0.03 OUTLIER Glycine 0 C--O 1.227 -0.327 0 O-C-N 120.627 -1.514 . . . . 0.0 113.339 -176.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 19.3 m -131.45 165.98 22.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 122.408 0.283 . . . . 0.0 111.742 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.7 p -54.0 -46.61 71.81 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 124.666 1.229 . . . . 0.0 112.251 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.469 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.4 t -132.15 -54.84 0.98 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.577 1.151 . . . . 0.0 111.424 -178.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 p -149.82 140.77 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 122.296 1.046 . . . . 0.0 110.605 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 76.6 m -83.2 138.93 33.42 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.904 -1.123 . . . . 0.0 109.98 171.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.1 140.98 48.84 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 122.855 1.312 . . . . 0.0 111.056 173.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.44 ' OD1' ' HB1' ' A' ' 20' ' ' ALA . 1.2 p30 -76.29 106.84 8.14 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 124.123 1.916 . . . . 0.0 112.889 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.851 HD21 ' HA3' ' A' ' 9' ' ' GLY . 12.5 mt -67.06 -36.19 81.49 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 119.284 -2.135 . . . . 0.0 110.908 -178.376 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.5 p . . . . . 0 N--CA 1.467 0.407 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 179.545 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt . . . . . 0 C--O 1.226 -0.178 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.08 -38.32 65.92 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.604 0.621 . . . . 0.0 113.935 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -89.62 16.1 8.4 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.494 1.518 . . . . 0.0 112.882 176.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.69 34.37 87.22 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.147 0.403 . . . . 0.0 112.732 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.94 174.96 32.24 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-O 122.569 1.094 . . . . 0.0 112.111 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.93 136.27 28.41 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 122.424 1.107 . . . . 0.0 112.136 -177.099 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.5 t -73.53 123.45 23.96 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.899 -1.126 . . . . 0.0 112.488 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -127.28 147.09 60.56 Favored Pre-proline 0 CA--C 1.538 0.501 0 O-C-N 120.639 -1.288 . . . . 0.0 111.088 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -67.25 153.93 75.72 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.33 2.02 . . . . 0.0 110.565 176.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.568 HD11 ' HA2' ' A' ' 67' ' ' GLY . 13.7 mt -61.18 -18.46 58.31 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.0 -14.99 57.43 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.72 1.208 . . . . 0.0 112.258 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -88.93 139.8 30.09 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.705 -1.247 . . . . 0.0 110.009 175.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -96.7 122.33 39.52 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.841 0.856 . . . . 0.0 110.808 174.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.4 p -167.67 169.81 11.52 Favored 'General case' 0 C--O 1.214 -0.813 0 C-N-CA 123.224 0.61 . . . . 0.0 110.575 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -74.06 111.19 8.98 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.937 -0.477 . . . . 0.0 110.575 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.36 136.07 53.8 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.97 1.308 . . . . 0.0 111.369 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -84.09 143.6 29.59 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 120.885 -1.134 . . . . 0.0 110.734 176.658 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.03 -41.87 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.736 0.814 . . . . 0.0 113.089 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.73 -36.15 67.7 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.74 -0.6 . . . . 0.0 111.432 176.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.72 -30.9 51.95 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 121.853 -0.529 . . . . 0.0 111.242 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.416 ' HB2' ' CE ' ' A' ' 69' ' ' LYS . 28.3 p -55.27 -31.34 61.5 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 124.552 1.141 . . . . 0.0 111.722 178.309 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.93 -34.76 65.92 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 118.058 -0.973 . . . . 0.0 112.813 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.4 t -46.53 -53.08 12.03 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.362 1.465 . . . . 0.0 111.886 177.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 2.2 m -87.21 -56.54 3.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.401 174.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 39.48 -147.03 0.19 Allowed Glycine 0 C--O 1.217 -0.947 0 C-N-CA 125.599 1.571 . . . . 0.0 112.094 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 77.8 mttt 47.42 46.37 17.25 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.052 1.426 . . . . 0.0 113.909 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.568 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 81.63 19.8 65.21 Favored Glycine 0 CA--C 1.534 1.245 0 N-CA-C 114.241 0.456 . . . . 0.0 114.241 -174.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -139.23 150.98 46.16 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.941 1.696 . . . . 0.0 110.23 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -121.2 157.89 29.25 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.402 1.081 . . . . 0.0 109.954 178.046 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 50.6 t -101.5 96.28 7.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.652 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 33.8 m -89.67 144.22 26.17 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.16 0.584 . . . . 0.0 111.455 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.7 p -114.44 142.47 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.099 0.96 . . . . 0.0 110.186 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 32.0 m95 . . . . . 0 CA--C 1.517 -0.312 0 C-N-CA 123.627 0.771 . . . . 0.0 112.601 175.668 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 120.414 0.149 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -48.8 -59.28 3.69 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.517 -0.739 . . . . 0.0 111.168 176.197 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.56 -29.01 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.8 t -70.29 -30.03 66.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.442 1.097 . . . . 0.0 111.714 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.2 mmtt -94.4 -10.12 33.52 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 175.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.58 30.69 10.28 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-O 118.486 -1.175 . . . . 0.0 113.172 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -91.29 169.58 10.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.814 1.307 . . . . 0.0 112.062 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -122.33 133.92 9.49 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.102 0.858 . . . . 0.0 111.507 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 68.1 m -81.23 134.85 35.68 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 121.911 -0.758 . . . . 0.0 111.487 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.44 ' O ' HG12 ' A' ' 30' ' ' VAL . 38.6 mt -145.76 155.78 52.24 Favored Pre-proline 0 C--O 1.22 -0.463 0 O-C-N 124.066 0.854 . . . . 0.0 111.87 178.656 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.08 141.8 71.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 123.222 2.615 . . . . 0.0 110.852 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.424 ' HA ' HG11 ' A' ' 30' ' ' VAL . 87.4 mt-30 -54.11 -22.18 10.38 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.059 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.7 p -69.23 -46.17 68.01 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 125.409 1.483 . . . . 0.0 113.004 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.54 -37.42 56.7 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.991 0.916 . . . . 0.0 111.96 176.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.6 t -89.33 118.75 69.4 Favored Pre-proline 0 C--O 1.243 0.724 0 O-C-N 121.433 -0.792 . . . . 0.0 111.832 -178.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -63.23 150.58 88.2 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.711 2.274 . . . . 0.0 110.833 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -54.27 -20.49 7.18 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -82.81 -24.52 33.31 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.884 1.273 . . . . 0.0 113.815 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -97.26 -19.91 18.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.848 1.659 . . . . 0.0 112.059 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -53.78 118.85 4.28 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 121.063 -1.023 . . . . 0.0 110.558 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.479 HD12 ' HB3' ' A' ' 31' ' ' CYS . 5.3 mt -103.0 173.85 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.315 1.055 . . . . 0.0 110.519 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.1 p -127.15 28.5 5.74 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 0.0 112.176 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -69.63 -18.15 63.57 Favored 'General case' 0 C--O 1.207 -1.156 0 O-C-N 121.481 -0.762 . . . . 0.0 110.988 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.88 87.32 0.08 OUTLIER Glycine 0 CA--C 1.526 0.726 0 CA-C-O 124.174 1.986 . . . . 0.0 112.032 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.68 31.15 0.03 OUTLIER Glycine 0 C--O 1.221 -0.718 0 O-C-N 120.346 -1.679 . . . . 0.0 113.694 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.406 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 93.3 m -138.83 145.39 40.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.219 0.509 . . . . 0.0 110.488 176.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.3 t -60.81 -40.78 93.97 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 124.156 0.91 . . . . 0.0 111.447 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.7 p -108.65 -73.62 0.68 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.727 1.211 . . . . 0.0 111.066 -177.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 11' ' ' LEU . 7.9 p -150.76 148.36 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.864 1.266 . . . . 0.0 110.74 175.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.479 ' HB3' HD12 ' A' ' 22' ' ' LEU . 2.0 m -76.72 136.56 39.07 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 120.948 -1.095 . . . . 0.0 109.964 171.624 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.45 133.2 55.45 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 125.067 1.347 . . . . 0.0 112.114 175.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.29 100.19 5.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 122.915 1.341 . . . . 0.0 113.46 178.547 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mt -59.35 -35.3 73.6 Favored 'General case' 0 C--O 1.22 -0.477 0 O-C-N 120.606 -1.309 . . . . 0.0 111.439 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 N--CA 1.467 0.419 0 C-N-CA 123.933 0.893 . . . . 0.0 112.622 178.954 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.4 mttm . . . . . 0 C--O 1.221 -0.418 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -52.28 -30.11 31.58 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-N 118.809 0.731 . . . . 0.0 114.227 178.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -78.46 10.75 2.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.051 1.74 . . . . 0.0 113.45 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.31 35.12 77.09 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.503 1.049 . . . . 0.0 112.624 -175.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -104.64 -176.61 24.92 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-O 122.554 1.085 . . . . 0.0 113.309 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -146.62 150.19 34.98 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 123.167 1.46 . . . . 0.0 111.979 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 85.0 m -73.17 118.25 15.9 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.692 -1.255 . . . . 0.0 111.581 174.238 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -116.26 146.86 38.23 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.908 0.883 . . . . 0.0 111.011 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.81 153.19 76.32 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.693 2.262 . . . . 0.0 110.665 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.9 mt -59.75 -25.07 64.56 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -72.43 -21.16 61.29 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.608 1.163 . . . . 0.0 112.796 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -92.58 130.66 38.16 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.006 -1.059 . . . . 0.0 110.705 176.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.26 133.04 44.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.946 174.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.493 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 0.6 OUTLIER -168.7 178.45 4.66 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.025 0.53 . . . . 0.0 110.288 174.453 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttt -102.75 105.86 16.37 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 123.755 0.822 . . . . 0.0 110.618 175.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -122.14 137.81 54.69 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.285 1.034 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -80.56 136.5 36.27 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.535 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -48.67 -37.62 19.0 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.443 ' HB3' HD12 ' A' ' 57' ' ' LEU . . . -78.39 -29.29 47.2 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.788 0.835 . . . . 0.0 112.248 178.02 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -81.61 -30.23 32.96 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.503 0.721 . . . . 0.0 111.221 177.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.6 t -57.2 -29.61 63.85 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.427 1.491 . . . . 0.0 111.385 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.7 -33.72 66.73 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.334 1.054 . . . . 0.0 113.387 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.8 t -52.29 -61.03 2.53 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.149 0.979 . . . . 0.0 111.833 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.1 m -75.85 -52.43 10.38 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 37.8 -146.31 0.12 Allowed Glycine 0 C--N 1.344 1.016 0 C-N-CA 126.73 2.109 . . . . 0.0 111.455 -176.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mttp 45.81 43.91 10.35 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 119.944 1.872 . . . . 0.0 114.029 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.73 17.71 74.64 Favored Glycine 0 CA--C 1.539 1.566 0 O-C-N 121.544 -0.722 . . . . 0.0 114.899 -175.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -130.31 150.64 51.45 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.878 2.071 . . . . 0.0 109.612 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -115.78 158.81 22.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.584 1.554 . . . . 0.0 110.365 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 39.9 t -108.08 92.66 4.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.001 0.52 . . . . 0.0 111.041 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 48.7 t -81.96 163.84 21.89 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.774 0.321 . . . . 0.0 111.661 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 p -123.14 144.29 33.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.012 1.325 . . . . 0.0 111.693 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.493 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 46.1 m95 . . . . . 0 CA--C 1.532 0.253 0 C-N-CA 124.507 1.123 . . . . 0.0 111.859 173.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 121.039 0.447 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 66.8 m -53.69 -54.49 37.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.712 1.205 . . . . 0.0 110.757 175.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -55.83 -38.07 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.052 1.341 . . . . 0.0 113.456 175.414 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.9 m -66.65 -23.66 66.18 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.303 1.041 . . . . 0.0 112.462 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 2.5 mmmm -97.03 -3.87 40.69 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 170.238 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.53 43.1 20.35 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.724 0.678 . . . . 0.0 112.319 -176.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 40.4 m-85 -105.63 159.21 16.14 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.54 1.17 . . . . 0.0 112.836 173.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.443 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -108.84 131.05 10.35 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.405 1.002 . . . . 0.0 111.796 -178.166 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.97 130.98 44.32 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.462 0.705 . . . . 0.0 111.86 172.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.1 mt -139.6 162.21 52.46 Favored Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 123.376 0.422 . . . . 0.0 110.782 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.498 ' HA ' HG21 ' A' ' 29' ' ' THR . 57.7 Cg_endo -68.07 138.95 45.25 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.48 2.12 . . . . 0.0 111.509 172.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -53.38 -14.91 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 174.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.27 -48.68 19.32 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.735 2.014 . . . . 0.0 112.218 170.069 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -76.04 -33.64 59.63 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.576 1.151 . . . . 0.0 112.071 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 29.8 t -86.67 115.32 61.91 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 120.917 -1.115 . . . . 0.0 111.406 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -62.68 152.35 78.64 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.17 1.914 . . . . 0.0 110.914 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -57.64 -19.39 26.17 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.901 0.88 . . . . 0.0 113.093 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -81.5 -25.82 35.67 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.498 1.919 . . . . 0.0 114.531 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -101.38 -15.17 17.3 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.912 1.685 . . . . 0.0 112.707 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -53.72 106.29 0.18 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.958 1.303 . . . . 0.0 111.874 172.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.562 HD21 ' CG ' ' A' ' 33' ' ' ASP . 16.0 mt -89.71 165.54 14.14 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 122.252 1.025 . . . . 0.0 111.738 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 t -116.78 21.4 13.39 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.404 1.482 . . . . 0.0 111.936 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.523 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 43.1 m-85 -63.27 -18.59 63.74 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 174.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.24 66.46 2.65 Favored Glycine 0 N--CA 1.474 1.224 0 CA-C-N 120.567 1.531 . . . . 0.0 113.713 176.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.02 31.87 0.29 Allowed Glycine 0 N--CA 1.462 0.428 0 O-C-N 120.905 -1.35 . . . . 0.0 114.038 -175.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 49.0 m -137.83 164.54 28.67 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.057 0.943 . . . . 0.0 112.955 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 t -61.22 -31.28 71.06 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.498 HG21 ' HA ' ' A' ' 12' ' ' PRO . 3.1 t -139.98 -58.17 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.066 1.346 . . . . 0.0 111.716 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.426 ' H ' HG23 ' A' ' 29' ' ' THR . 5.5 p -147.3 155.23 11.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 122.088 0.947 . . . . 0.0 110.755 174.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 74.0 m -95.53 141.42 29.08 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 172.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -122.03 137.24 54.88 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.248 1.019 . . . . 0.0 111.787 177.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.562 ' CG ' HD21 ' A' ' 22' ' ' LEU . 5.1 m-20 -74.23 103.86 4.8 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 122.082 0.944 . . . . 0.0 110.96 -178.417 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.563 HD22 ' HB3' ' A' ' 41' ' ' LYS . 44.5 mt -57.42 -43.34 83.74 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.967 -1.083 . . . . 0.0 111.749 178.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.468 0.463 0 C-N-CA 124.467 1.107 . . . . 0.0 113.743 177.766 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.563 ' HB3' HD22 ' A' ' 34' ' ' LEU . 47.7 mttp . . . . . 0 N--CA 1.469 0.507 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.4 -36.8 64.1 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.083 0.849 . . . . 0.0 114.201 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -78.33 11.27 2.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.91 1.684 . . . . 0.0 113.448 172.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.39 18.59 63.4 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.239 1.876 . . . . 0.0 114.34 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.76 170.4 54.96 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 124.328 0.966 . . . . 0.0 112.742 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -137.96 142.61 40.5 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 122.733 1.254 . . . . 0.0 111.302 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.1 t -68.21 127.17 31.93 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.461 -0.774 . . . . 0.0 111.54 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -124.47 150.47 64.68 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 123.332 0.653 . . . . 0.0 111.887 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -71.12 157.44 57.55 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.384 2.056 . . . . 0.0 111.924 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -59.83 -27.35 66.56 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.45 -17.82 62.35 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.216 2.606 . . . . 0.0 113.08 176.23 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -88.14 129.17 35.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.944 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.88 121.36 21.74 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.272 0.629 . . . . 0.0 110.834 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -160.58 -176.93 5.86 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.989 1.316 . . . . 0.0 109.695 167.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.8 tppt? -92.71 126.08 37.63 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.904 1.282 . . . . 0.0 109.312 166.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.483 ' CD ' ' HE3' ' A' ' 69' ' ' LYS . 2.1 pm0 -124.9 146.98 49.07 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.325 1.45 . . . . 0.0 110.335 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -94.93 148.89 21.83 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.594 -0.691 . . . . 0.0 110.69 175.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -58.97 -42.56 90.2 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.0 0.92 . . . . 0.0 112.699 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.52 -30.09 57.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.3 1.04 . . . . 0.0 111.908 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.22 -37.44 20.09 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.053 0.941 . . . . 0.0 111.852 -178.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -58.07 -33.37 68.99 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.155 -1.591 . . . . 0.0 112.212 172.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.38 -41.69 72.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.54 0.736 . . . . 0.0 112.346 172.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.8 p -80.79 -19.65 44.3 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -63.82 -25.24 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.052 0.842 . . . . 0.0 111.619 174.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.11 163.12 16.72 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 122.419 1.011 . . . . 0.0 112.083 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.2 mttm -61.3 123.44 17.75 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.444 -1.033 . . . . 0.0 110.416 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.05 22.89 60.25 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.664 -1.076 . . . . 0.0 113.518 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -135.59 165.65 25.06 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.267 1.827 . . . . 0.0 111.452 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.483 ' HE3' ' CD ' ' A' ' 56' ' ' GLU . 54.6 mtpt -138.76 115.47 10.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.426 1.89 . . . . 0.0 111.941 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.3 t -73.39 104.94 4.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.91 -0.494 . . . . 0.0 110.921 -176.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.96 158.61 16.63 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.102 0.961 . . . . 0.0 110.994 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.7 m -132.48 145.41 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.712 1.605 . . . . 0.0 110.956 177.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 66.3 m95 . . . . . 0 N--CA 1.472 0.645 0 C-N-CA 124.736 1.214 . . . . 0.0 112.827 -176.466 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.1 m -54.42 -63.92 1.0 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.016 -1.052 . . . . 0.0 111.056 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.1 p -56.3 -35.2 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.447 0.699 . . . . 0.0 112.703 177.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.4 m -60.65 -29.48 69.29 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.64 1.176 . . . . 0.0 112.002 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -97.15 -8.94 28.91 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 172.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.7 32.4 30.32 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.836 -0.98 . . . . 0.0 113.2 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -78.62 170.16 17.1 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.336 1.568 . . . . 0.0 112.549 174.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.753 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -112.82 116.12 3.91 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 125.321 1.439 . . . . 0.0 111.081 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.43 129.9 38.07 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.694 -0.886 . . . . 0.0 111.699 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.1 mt -143.13 159.08 57.14 Favored Pre-proline 0 C--O 1.22 -0.457 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.888 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.412 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 59.3 Cg_endo -68.55 144.97 62.73 Favored 'Trans proline' 0 C--O 1.217 -0.563 0 C-N-CA 123.407 2.738 . . . . 0.0 112.549 173.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.453 ' OE1' HG21 ' A' ' 30' ' ' VAL . 20.5 mm-40 -53.04 -18.97 2.36 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 177.135 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.0 t -72.55 -49.19 34.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.694 2.397 . . . . 0.0 111.77 169.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -76.79 -34.2 57.97 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.369 1.067 . . . . 0.0 110.59 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.0 t -95.21 115.34 65.33 Favored Pre-proline 0 C--O 1.242 0.686 0 O-C-N 120.608 -1.308 . . . . 0.0 111.633 -175.008 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -62.83 153.61 71.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.958 2.438 . . . . 0.0 110.746 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -53.44 -31.93 47.53 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.46 -18.13 61.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.834 1.254 . . . . 0.0 113.239 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.39 -23.45 15.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.32 1.448 . . . . 0.0 113.599 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -53.07 117.71 3.2 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.305 -0.872 . . . . 0.0 110.759 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.479 HD12 ' SG ' ' A' ' 31' ' ' CYS . 2.5 mt -103.35 172.2 6.95 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.375 1.084 . . . . 0.0 111.195 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -117.83 25.51 10.32 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.122 1.369 . . . . 0.0 112.336 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -70.66 -14.66 62.55 Favored 'General case' 0 C--O 1.211 -0.956 0 C-N-CA 123.528 0.731 . . . . 0.0 111.964 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.33 85.19 0.02 OUTLIER Glycine 0 N--CA 1.469 0.858 0 CA-C-O 123.243 1.468 . . . . 0.0 113.627 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.16 29.51 0.02 OUTLIER Glycine 0 C--O 1.225 -0.458 0 O-C-N 120.604 -1.527 . . . . 0.0 114.202 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.7 m -129.7 158.71 38.62 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.475 1.11 . . . . 0.0 111.169 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.6 m -47.68 -48.57 29.09 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.399 1.08 . . . . 0.0 112.785 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -128.22 -59.03 1.19 Allowed 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.518 1.527 . . . . 0.0 110.961 179.62 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.453 HG21 ' OE1' ' A' ' 13' ' ' GLN . 7.6 p -145.06 145.14 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 122.886 1.327 . . . . 0.0 109.676 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.479 ' SG ' HD12 ' A' ' 22' ' ' LEU . 1.8 t -82.59 139.16 33.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.561 171.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.73 132.88 56.41 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.955 1.702 . . . . 0.0 110.781 174.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.455 ' HB3' HD21 ' A' ' 22' ' ' LEU . 0.7 OUTLIER -74.16 103.49 4.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 123.28 1.514 . . . . 0.0 112.319 176.27 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.753 HD21 ' HA3' ' A' ' 9' ' ' GLY . 16.6 mt -55.06 -42.25 72.49 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.697 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.529 1.532 . . . . 0.0 113.205 179.766 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.499 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.224 -0.275 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.97 -36.66 74.71 Favored Glycine 0 CA--C 1.533 1.189 0 O-C-N 123.711 0.632 . . . . 0.0 113.247 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.3 mtmm -86.36 16.43 4.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.465 1.906 . . . . 0.0 114.137 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.12 47.69 79.23 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.46 1.028 . . . . 0.0 112.993 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -101.34 164.36 18.0 Favored Glycine 0 C--O 1.244 0.728 0 C-N-CA 124.799 1.19 . . . . 0.0 113.953 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -133.3 145.97 50.93 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.905 1.682 . . . . 0.0 110.625 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.9 m -73.28 121.04 19.73 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.088 -1.008 . . . . 0.0 111.113 175.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -120.23 150.01 50.63 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.998 0.919 . . . . 0.0 111.187 177.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -68.95 154.11 71.42 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.434 2.089 . . . . 0.0 110.553 176.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.498 HD23 ' HD3' ' A' ' 69' ' ' LYS . 82.7 mt -60.29 -20.83 60.74 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 174.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -70.54 -17.27 62.93 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.372 1.869 . . . . 0.0 111.952 173.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -92.94 132.35 37.13 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 120.667 -1.27 . . . . 0.0 110.44 177.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -90.05 119.29 30.28 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.627 0.771 . . . . 0.0 110.376 174.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -167.26 166.58 14.69 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.769 1.227 . . . . 0.0 110.241 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.3 tttt -71.48 112.11 7.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.477 1.111 . . . . 0.0 108.928 175.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.462 ' HG2' ' CE ' ' A' ' 69' ' ' LYS . 1.9 pp20? -120.15 142.85 48.58 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 124.003 0.921 . . . . 0.0 109.618 175.713 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -98.27 141.18 31.49 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.603 0.761 . . . . 0.0 111.191 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -62.21 -39.61 93.34 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.073 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.49 -32.34 58.27 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.707 0.765 . . . . 0.0 111.772 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.06 -35.56 56.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.9 t -52.18 -34.82 46.89 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.998 1.319 . . . . 0.0 112.359 174.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.97 63.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.242 1.017 . . . . 0.0 112.734 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 40.4 t -60.08 -54.98 39.51 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.037 1.735 . . . . 0.0 111.176 175.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 87.5 m -63.19 -43.17 98.97 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 117.88 176.85 17.2 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 122.716 1.175 . . . . 0.0 113.098 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -62.42 131.75 50.26 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.793 -0.828 . . . . 0.0 111.597 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.82 -2.87 82.68 Favored Glycine 0 CA--C 1.531 1.064 0 CA-C-O 118.345 -1.253 . . . . 0.0 113.942 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.2 164.12 16.72 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.396 1.878 . . . . 0.0 109.656 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.498 ' HD3' HD23 ' A' ' 50' ' ' LEU . 23.7 mtpt -133.55 125.09 28.1 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.239 1.816 . . . . 0.0 109.725 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 t -78.61 100.4 6.97 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 122.855 0.462 . . . . 0.0 111.035 176.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.47 136.66 38.27 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.648 0.737 . . . . 0.0 111.043 176.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.6 m -103.66 144.46 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.154 0.982 . . . . 0.0 111.21 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.8 m95 . . . . . 0 CA--C 1.531 0.221 0 C-N-CA 123.374 0.67 . . . . 0.0 111.326 179.047 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 121.678 0.752 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.3 m -56.91 -57.55 12.02 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 121.175 -0.953 . . . . 0.0 110.638 178.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.26 -33.01 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.66 -0.65 . . . . 0.0 112.384 177.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -62.29 -31.13 71.68 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.329 0.652 . . . . 0.0 111.28 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.41 ' HB2' ' CD2' ' A' ' 8' ' ' PHE . 28.3 mmtm -96.95 -10.44 26.32 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.24 45.5 4.08 Favored Glycine 0 C--O 1.222 -0.651 0 CA-C-O 118.423 -1.209 . . . . 0.0 111.324 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.506 ' CE2' ' CZ ' ' A' ' 24' ' ' TYR . 77.3 m-85 -108.27 163.25 13.35 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.121 0.96 . . . . 0.0 111.358 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 131.84 10.42 Favored Glycine 0 CA--C 1.523 0.536 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.781 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.8 m -80.43 118.99 22.54 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.048 177.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 30' ' ' VAL . 30.6 mt -132.93 154.95 81.6 Favored Pre-proline 0 C--O 1.211 -0.944 0 O-C-N 124.171 0.92 . . . . 0.0 112.025 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.52 141.21 72.67 Favored 'Trans proline' 0 C--O 1.213 -0.769 0 C-N-CA 124.394 3.396 . . . . 0.0 110.395 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.594 ' HA ' HG11 ' A' ' 30' ' ' VAL . 1.1 pt20 -49.79 -30.97 10.63 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.896 0.879 . . . . 0.0 112.594 177.014 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 t -65.85 -44.53 85.18 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.185 1.179 . . . . 0.0 114.185 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.408 ' OD1' HD13 ' A' ' 11' ' ' LEU . 8.2 t70 -70.5 -47.57 59.86 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.392 0.677 . . . . 0.0 112.363 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -86.0 128.74 56.84 Favored Pre-proline 0 CA--C 1.541 0.615 0 CA-C-O 121.422 0.629 . . . . 0.0 111.9 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -65.5 144.71 80.32 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.289 1.992 . . . . 0.0 110.958 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -51.85 -19.74 1.88 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 173.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -78.31 -36.11 46.92 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.779 0.832 . . . . 0.0 112.792 176.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.72 -28.31 26.4 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 116.026 -1.94 . . . . 0.0 110.776 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.535 ' HG2' HG21 ' A' ' 30' ' ' VAL . 84.0 mtt180 -44.14 119.82 1.92 Allowed 'General case' 0 C--N 1.345 0.396 0 O-C-N 125.105 1.503 . . . . 0.0 110.625 178.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.486 HD13 ' CE2' ' A' ' 24' ' ' TYR . 3.4 mt -103.18 178.4 4.57 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.2 p -121.35 30.26 6.86 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.157 0.983 . . . . 0.0 111.109 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.506 ' CZ ' ' CE2' ' A' ' 8' ' ' PHE . 62.7 m-85 -69.14 -19.18 64.02 Favored 'General case' 0 C--O 1.202 -1.409 0 CA-C-O 119.085 -0.483 . . . . 0.0 110.461 177.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.53 49.68 75.91 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 120.768 1.622 . . . . 0.0 111.804 178.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -143.23 36.67 1.56 Allowed Glycine 0 C--O 1.223 -0.592 0 CA-C-O 117.944 -1.476 . . . . 0.0 112.703 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 91.5 m -144.94 151.25 38.35 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 117.59 0.695 . . . . 0.0 111.4 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 p -63.22 -43.22 98.72 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 123.652 0.595 . . . . 0.0 111.558 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.1 p -105.93 -74.67 0.65 Allowed 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.001 0.52 . . . . 0.0 109.744 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.594 HG11 ' HA ' ' A' ' 13' ' ' GLN . 9.9 p -151.92 144.42 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 123.499 1.619 . . . . 0.0 111.336 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.8 t -80.34 128.24 33.33 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 120.594 -1.316 . . . . 0.0 111.059 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -106.43 138.27 42.92 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 124.049 0.843 . . . . 0.0 112.033 177.098 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -83.11 104.66 13.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.6 mt -65.26 -30.39 71.26 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 120.837 -1.164 . . . . 0.0 110.854 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 p . . . . . 0 N--CA 1.464 0.265 0 O-C-N 120.484 -1.385 . . . . 0.0 112.634 178.546 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp . . . . . 0 C--O 1.216 -0.664 0 CA-C-O 119.242 -0.408 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.68 -31.67 45.74 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 122.994 0.331 . . . . 0.0 112.854 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -77.05 14.53 0.85 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.69 32.87 85.64 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 123.958 0.789 . . . . 0.0 112.091 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.411 ' CA ' ' HA ' ' A' ' 72' ' ' VAL . . . -99.74 179.2 30.21 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 122.091 0.828 . . . . 0.0 113.168 178.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -146.8 153.67 40.46 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 123.218 1.485 . . . . 0.0 111.719 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.1 m -67.48 131.68 46.15 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.702 -1.249 . . . . 0.0 113.196 172.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -130.44 148.87 71.66 Favored Pre-proline 0 N--CA 1.452 -0.366 0 CA-C-O 121.65 0.738 . . . . 0.0 111.594 178.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.86 152.28 77.45 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.584 2.189 . . . . 0.0 111.405 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.634 HD23 ' HG3' ' A' ' 69' ' ' LYS . 12.9 mt -63.49 -18.96 64.34 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 176.12 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -81.34 -12.7 58.94 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.724 0.81 . . . . 0.0 111.399 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -94.19 136.09 34.86 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 120.965 -1.085 . . . . 0.0 110.444 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -86.19 123.2 31.21 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.986 176.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -169.74 -176.86 2.5 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.48 0.712 . . . . 0.0 111.156 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -97.4 109.02 21.86 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.611 0.764 . . . . 0.0 112.837 174.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -113.05 137.51 51.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.133 0.968 . . . . 0.0 110.987 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -83.28 145.34 29.15 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.53 176.237 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.404 ' N ' HD13 ' A' ' 57' ' ' LEU . 40.9 mm-40 -66.75 -42.59 85.95 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.594 0.711 . . . . 0.0 112.776 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.48 -32.53 64.35 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.474 -0.766 . . . . 0.0 111.869 177.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -78.22 -39.5 40.27 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.409 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.5 p -53.18 -32.62 48.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 124.721 1.209 . . . . 0.0 112.0 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.22 -30.28 64.44 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.1 p -61.36 -51.45 68.77 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 123.39 0.676 . . . . 0.0 111.665 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.4 t -66.23 -33.91 76.82 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.55 0.34 . . . . 0.0 110.117 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -178.92 27.99 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 123.291 1.495 . . . . 0.0 112.155 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -64.14 154.01 35.98 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.208 -1.172 . . . . 0.0 111.361 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.588 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 72.21 8.84 71.09 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.745 -178.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -143.06 157.24 44.71 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.048 0.939 . . . . 0.0 110.604 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.634 ' HG3' HD23 ' A' ' 50' ' ' LEU . 5.6 mtmp? -128.53 120.65 27.17 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.384 0.674 . . . . 0.0 111.001 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.3 t -80.15 102.09 9.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.212 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.19 168.26 14.14 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 175.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.411 ' HA ' ' CA ' ' A' ' 45' ' ' GLY . 8.0 p -128.43 144.44 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 C-N-CA 123.763 0.825 . . . . 0.0 111.237 177.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 23.8 m95 . . . . . 0 CA--C 1.517 -0.297 0 CA-C-O 121.89 0.852 . . . . 0.0 111.786 175.989 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 . . . . . 0 C--O 1.212 -0.883 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -46.26 -56.04 6.32 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 121.411 -0.806 . . . . 0.0 110.99 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.9 -23.88 21.97 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.634 0 CA-C-O 121.054 0.454 . . . . 0.0 111.681 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 t -64.66 -35.13 80.04 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 121.516 0.674 . . . . 0.0 111.203 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.497 ' HD3' ' CD2' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -97.23 -13.75 21.83 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.811 -0.556 . . . . 0.0 111.602 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.2 29.84 7.33 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 119.018 -0.879 . . . . 0.0 112.621 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.441 ' CD2' ' HB2' ' A' ' 6' ' ' LYS . 57.4 m-85 -85.38 173.89 9.96 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.374 0.587 . . . . 0.0 111.389 179.147 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.2 131.71 7.3 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.644 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.8 m -83.73 132.18 34.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 122.608 -0.348 . . . . 0.0 111.134 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.0 mt -151.24 154.66 34.11 Favored Pre-proline 0 C--O 1.199 -1.555 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.27 137.54 40.47 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.84 3.027 . . . . 0.0 111.626 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.405 ' CG ' HG11 ' A' ' 30' ' ' VAL . 87.2 mt-30 -46.82 -31.27 2.93 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 123.111 0.564 . . . . 0.0 110.437 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.7 t -57.78 -43.95 85.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 121.782 -0.574 . . . . 0.0 112.368 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -86.4 -33.66 20.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.548 0.69 . . . . 0.0 112.117 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.5 t -90.63 125.22 60.2 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-O 121.498 0.666 . . . . 0.0 111.345 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.47 148.93 74.13 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.024 2.482 . . . . 0.0 111.712 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -14.59 6.15 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.054 0.541 . . . . 0.0 111.844 177.423 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -85.82 -23.71 27.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.84 0.456 . . . . 0.0 112.116 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.405 ' HB1' ' H ' ' A' ' 33' ' ' ASP . . . -98.2 -25.41 14.9 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 122.74 0.416 . . . . 0.0 111.114 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.523 ' HD3' HG21 ' A' ' 30' ' ' VAL . 63.0 mtt180 -46.9 123.44 5.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.344 0.658 . . . . 0.0 110.3 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.0 mt -107.99 177.07 4.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.343 0.592 . . . . 0.0 110.406 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.8 m -133.04 36.36 3.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.816 0.817 . . . . 0.0 111.341 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.497 ' CD2' ' HD3' ' A' ' 6' ' ' LYS . 11.3 m-85 -71.54 -18.35 62.27 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 121.716 -0.615 . . . . 0.0 110.74 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.9 82.79 0.12 Allowed Glycine 0 C--O 1.22 -0.731 0 CA-C-O 122.83 1.239 . . . . 0.0 111.728 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 178.87 26.46 0.04 OUTLIER Glycine 0 C--O 1.22 -0.726 0 O-C-N 120.545 -1.562 . . . . 0.0 113.245 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 86.5 m -129.75 149.97 51.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.595 0.358 . . . . 0.0 111.477 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.4 p -63.97 -39.83 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.189 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.9 p -112.39 -75.22 0.61 Allowed 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 121.358 0.599 . . . . 0.0 110.627 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.523 HG21 ' HD3' ' A' ' 21' ' ' ARG . 7.1 p -152.99 134.11 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-O 123.387 1.565 . . . . 0.0 111.057 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 m -69.83 138.05 52.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 120.124 -1.61 . . . . 0.0 111.513 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -114.12 148.77 36.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.151 0.501 . . . . 0.0 111.084 178.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.405 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 8.5 t70 -92.25 106.33 18.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.163 0.506 . . . . 0.0 110.848 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 mt -66.87 -35.0 79.03 Favored 'General case' 0 C--O 1.219 -0.548 0 O-C-N 121.849 -0.532 . . . . 0.0 110.879 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.332 -0.18 0 C-N-CA 122.58 0.352 . . . . 0.0 111.542 178.968 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.307 0 CA-C-O 120.814 0.34 . . . . 0.0 110.79 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.82 -42.79 92.12 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -79.58 9.43 4.98 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.675 0.39 . . . . 0.0 111.658 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.17 38.85 24.91 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 112.337 -0.305 . . . . 0.0 112.337 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.94 173.37 19.09 Favored Glycine 0 N--CA 1.451 -0.35 0 O-C-N 122.591 -0.359 . . . . 0.0 112.506 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -151.71 157.32 41.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.158 0.98 . . . . 0.0 111.639 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 t -71.95 133.39 45.34 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 121.409 -0.807 . . . . 0.0 111.612 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -133.84 147.74 65.5 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 122.021 0.915 . . . . 0.0 111.65 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.28 156.19 66.6 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.943 2.429 . . . . 0.0 112.111 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.464 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 18.3 mt -60.25 -16.44 33.81 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.609 178.124 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -80.69 -14.38 58.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.425 0.631 . . . . 0.0 111.49 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -90.93 147.37 23.17 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 121.378 -0.826 . . . . 0.0 110.746 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -106.68 122.07 45.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.357 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -174.74 164.87 3.64 Favored 'General case' 0 C--O 1.2 -1.525 0 C-N-CA 122.739 0.415 . . . . 0.0 111.877 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm -75.25 113.4 12.57 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.637 -0.664 . . . . 0.0 110.296 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.21 132.57 46.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 122.188 0.994 . . . . 0.0 110.842 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 tp -80.96 132.29 35.39 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.084 -1.01 . . . . 0.0 110.588 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -55.88 -39.3 71.34 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 122.154 -0.341 . . . . 0.0 111.575 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.77 70.21 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.691 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -78.68 -36.72 43.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 122.411 0.285 . . . . 0.0 111.51 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 18.6 m -51.96 -37.79 54.24 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 123.411 0.684 . . . . 0.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.27 -28.36 58.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.9 m -56.93 -58.27 8.9 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.237 0.615 . . . . 0.0 110.805 179.307 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.3 m -60.16 -37.97 81.76 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.137 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 119.31 -156.41 15.75 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-O 122.173 0.874 . . . . 0.0 111.871 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.5 pttt -89.25 133.14 34.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 O-C-N 121.614 -0.933 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 13.74 60.38 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 121.188 -0.529 . . . . 0.0 113.032 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -144.56 150.0 36.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.865 0.466 . . . . 0.0 111.034 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.464 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 16.5 mmtp -127.95 122.03 31.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.434 0.635 . . . . 0.0 111.456 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -78.47 110.51 13.61 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.822 -0.549 . . . . 0.0 111.431 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 95.6 m -99.46 162.61 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.509 0.671 . . . . 0.0 111.509 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.1 p -119.18 144.55 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.816 -0.553 . . . . 0.0 110.971 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 29.6 m95 . . . . . 0 C--N 1.325 -0.478 0 CA-C-O 121.544 0.688 . . . . 0.0 111.056 178.577 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 110.475 -0.194 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -50.9 -48.05 60.6 Favored 'General case' 0 C--N 1.342 0.25 0 O-C-N 121.644 -0.66 . . . . 0.0 111.853 177.268 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.6 p -57.17 -29.96 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 t -71.17 -29.59 65.38 Favored 'General case' 0 C--O 1.23 0.043 0 C-N-CA 124.252 1.021 . . . . 0.0 111.247 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.473 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -94.02 -11.81 29.98 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 174.452 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.98 45.76 4.7 Favored Glycine 0 C--O 1.224 -0.504 0 O-C-N 124.339 1.025 . . . . 0.0 111.693 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.455 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 54.0 m-85 -111.21 163.75 13.59 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.401 1.101 . . . . 0.0 111.369 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.94 136.08 12.66 Favored Glycine 0 CA--C 1.522 0.504 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 83.3 m -80.56 125.36 29.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.621 176.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.633 HD13 ' OD2' ' A' ' 15' ' ' ASP . 48.7 mt -137.7 155.94 74.84 Favored Pre-proline 0 C--O 1.214 -0.799 0 O-C-N 124.01 0.819 . . . . 0.0 112.078 179.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.1 140.81 67.05 Favored 'Trans proline' 0 C--O 1.214 -0.697 0 C-N-CA 124.254 3.303 . . . . 0.0 110.255 178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.589 ' HA ' HG11 ' A' ' 30' ' ' VAL . 1.0 OUTLIER -49.5 -31.0 9.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.959 0.903 . . . . 0.0 112.745 176.68 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.0 t -66.13 -44.92 82.84 Favored 'General case' 0 C--O 1.224 -0.289 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.633 ' OD2' HD13 ' A' ' 11' ' ' LEU . 25.3 t70 -72.41 -44.97 61.71 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.571 0.748 . . . . 0.0 112.475 175.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.408 ' SG ' ' HB3' ' A' ' 20' ' ' ALA . 13.9 t -89.51 124.68 63.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 121.444 -0.785 . . . . 0.0 112.278 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -64.01 149.27 90.87 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.694 2.263 . . . . 0.0 111.206 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -54.2 -18.15 3.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -79.34 -32.66 43.35 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.968 0.907 . . . . 0.0 113.198 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.408 ' HB3' ' SG ' ' A' ' 16' ' ' CYS . . . -90.02 -23.2 21.55 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.686 177.444 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.656 ' HG2' HG21 ' A' ' 30' ' ' VAL . 95.4 mtt180 -45.48 116.49 1.17 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.938 0.895 . . . . 0.0 110.701 178.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.587 HD12 ' HB3' ' A' ' 31' ' ' CYS . 15.1 mt -95.52 177.27 5.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 122.339 1.066 . . . . 0.0 109.267 -178.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.1 m -130.4 28.68 4.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.192 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.473 ' CE1' ' HG3' ' A' ' 6' ' ' LYS . 37.7 m-85 -70.4 -19.36 63.01 Favored 'General case' 0 C--O 1.211 -0.936 0 O-C-N 121.891 -0.505 . . . . 0.0 111.525 177.354 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.89 78.87 0.26 Allowed Glycine 0 CA--C 1.527 0.839 0 CA-C-O 124.19 1.995 . . . . 0.0 111.555 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.29 27.88 0.09 OUTLIER Glycine 0 C--O 1.218 -0.86 0 O-C-N 118.968 -2.489 . . . . 0.0 112.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 84.5 m -135.62 143.48 45.58 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 117.863 0.831 . . . . 0.0 111.125 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.8 m -61.6 -33.99 74.86 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.519 1.137 . . . . 0.0 111.531 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 54.3 p -113.23 -76.0 0.59 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 123.184 0.593 . . . . 0.0 111.011 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.656 HG21 ' HG2' ' A' ' 21' ' ' ARG . 8.6 p -151.69 145.19 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 123.255 1.502 . . . . 0.0 111.261 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.587 ' HB3' HD12 ' A' ' 22' ' ' LEU . 1.9 m -81.17 137.04 35.93 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 120.07 -1.644 . . . . 0.0 110.303 175.61 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.07 141.08 46.18 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.654 0.782 . . . . 0.0 112.165 176.349 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.577 ' HB2' HD21 ' A' ' 22' ' ' LEU . 17.7 t0 -83.57 104.61 13.84 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.904 0.859 . . . . 0.0 110.434 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.487 HD22 ' HE2' ' A' ' 41' ' ' LYS . 60.7 mt -66.08 -32.61 74.17 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 121.432 -0.792 . . . . 0.0 110.992 177.066 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.1 m . . . . . 0 C--N 1.322 -0.594 0 O-C-N 119.544 -1.973 . . . . 0.0 112.45 177.289 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.487 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.511 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -62.48 -37.88 95.41 Favored Glycine 0 C--O 1.219 -0.808 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -177.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -78.87 15.93 0.99 Allowed 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.971 0.908 . . . . 0.0 112.508 174.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 65.89 30.54 77.33 Favored Glycine 0 CA--C 1.529 0.932 0 O-C-N 121.386 -0.821 . . . . 0.0 112.078 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.62 166.4 54.14 Favored Glycine 0 CA--C 1.524 0.653 0 O-C-N 122.033 -0.687 . . . . 0.0 112.388 177.295 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -144.44 154.73 43.25 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.656 1.217 . . . . 0.0 111.206 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.4 109.09 4.01 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.573 -0.704 . . . . 0.0 112.491 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -106.81 148.7 37.38 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 121.805 0.812 . . . . 0.0 111.993 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -67.14 153.54 77.21 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.55 2.167 . . . . 0.0 110.99 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.422 HD22 ' HE3' ' A' ' 69' ' ' LYS . 18.5 mt -60.21 -16.45 33.5 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 174.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -78.25 -18.21 55.65 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.098 0.959 . . . . 0.0 112.258 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -87.38 145.65 26.22 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.455 -1.403 . . . . 0.0 110.822 176.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -98.95 121.96 41.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.886 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -174.17 161.27 3.52 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 123.832 0.853 . . . . 0.0 111.202 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.19 110.52 6.7 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 122.702 0.401 . . . . 0.0 110.748 177.14 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.442 ' OE1' ' HB3' ' A' ' 61' ' ' SER . 0.8 OUTLIER -125.11 133.57 52.81 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.619 1.199 . . . . 0.0 110.112 178.191 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.531 HD23 ' HG2' ' A' ' 60' ' ' GLU . 22.1 tp -82.48 129.21 34.86 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 171.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -51.67 -40.01 59.28 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.441 -0.787 . . . . 0.0 113.002 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.45 -24.75 67.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.273 1.029 . . . . 0.0 111.998 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' HD23 ' A' ' 57' ' ' LEU . 27.2 mm-40 -91.17 -42.5 10.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.662 1.185 . . . . 0.0 113.489 176.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.442 ' HB3' ' OE1' ' A' ' 56' ' ' GLU . 24.8 p -52.24 -26.68 12.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.739 0.699 . . . . 0.0 112.82 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.27 85.16 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 175.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.5 t -67.33 -50.26 60.77 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.186 0.994 . . . . 0.0 111.635 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 10.8 m -51.71 -38.32 54.65 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.667 0.387 . . . . 0.0 112.043 178.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 121.08 156.36 9.78 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.808 1.227 . . . . 0.0 111.036 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -51.68 129.97 27.3 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.168 -1.195 . . . . 0.0 110.992 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.71 12.14 64.79 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -135.63 157.21 47.43 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 124.101 0.961 . . . . 0.0 110.445 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.422 ' HE3' HD22 ' A' ' 50' ' ' LEU . 73.7 mttt -135.17 120.58 19.14 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 124.834 1.253 . . . . 0.0 110.34 -178.69 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.78 98.84 0.56 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.447 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 65.8 m -97.31 159.85 14.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.738 1.256 . . . . 0.0 111.351 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -111.97 145.29 18.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 O-C-N 121.522 -0.736 . . . . 0.0 110.92 177.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.9 m95 . . . . . 0 CA--C 1.51 -0.571 0 CA-C-O 117.609 -1.186 . . . . 0.0 113.889 178.97 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 . . . . . 0 N--CA 1.472 0.639 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.581 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 68.3 m -51.32 -60.16 3.43 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.732 1.213 . . . . 0.0 110.102 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -57.54 -33.71 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 175.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t -64.79 -26.87 68.53 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.983 1.313 . . . . 0.0 111.793 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 -10.65 23.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.505 174.078 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.15 30.83 21.64 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 124.32 0.962 . . . . 0.0 113.666 -177.263 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -82.39 165.32 20.39 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.249 1.024 . . . . 0.0 112.776 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.2 123.2 6.59 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.609 1.1 . . . . 0.0 111.721 178.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -72.85 131.53 42.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.636 -0.92 . . . . 0.0 111.878 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.5 mt -140.99 161.84 51.54 Favored Pre-proline 0 CA--C 1.535 0.369 0 O-C-N 124.007 0.817 . . . . 0.0 111.107 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.98 142.27 50.9 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.364 2.043 . . . . 0.0 111.067 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.45 -20.39 7.47 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -70.24 -46.81 63.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.049 1.34 . . . . 0.0 112.525 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.29 -39.08 49.25 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.334 1.053 . . . . 0.0 111.076 176.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.8 t -86.68 110.92 36.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 O-C-N 120.481 -1.387 . . . . 0.0 112.024 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -61.24 150.29 85.34 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.911 2.407 . . . . 0.0 110.434 -178.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -49.97 -23.68 2.15 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 176.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -72.46 -42.49 64.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.465 1.906 . . . . 0.0 111.818 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.26 -20.6 31.92 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.337 -1.316 . . . . 0.0 113.049 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -52.14 106.39 0.15 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.282 1.401 . . . . 0.0 111.802 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.703 HD21 ' HB2' ' A' ' 33' ' ' ASP . 17.0 mt -90.19 172.7 8.61 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.826 0.822 . . . . 0.0 111.259 -179.426 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 m -123.72 27.36 7.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 112.786 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.581 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 11.8 m-85 -71.75 -15.81 62.19 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.371 0.668 . . . . 0.0 111.489 178.779 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.99 80.43 0.09 OUTLIER Glycine 0 N--CA 1.468 0.818 0 CA-C-O 123.63 1.684 . . . . 0.0 112.432 175.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -178.39 28.27 0.06 OUTLIER Glycine 0 C--O 1.223 -0.587 0 O-C-N 120.509 -1.583 . . . . 0.0 114.904 -176.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 52.0 m -133.7 159.71 39.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 123.54 0.736 . . . . 0.0 110.981 175.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.2 m -52.39 -48.59 65.54 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 124.175 0.99 . . . . 0.0 112.927 -179.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.58 -61.52 1.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.34 1.456 . . . . 0.0 110.557 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.3 p -144.35 153.27 15.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.682 0.753 . . . . 0.0 111.294 176.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 82.9 m -90.77 136.5 33.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.741 0.816 . . . . 0.0 109.109 171.445 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -114.29 137.37 51.88 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.995 1.318 . . . . 0.0 111.821 174.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.703 ' HB2' HD21 ' A' ' 22' ' ' LEU . 19.5 t0 -81.71 101.52 10.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.027 -179.588 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 mt -62.75 -35.53 80.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.954 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.472 0.629 0 C-N-CA 125.524 1.53 . . . . 0.0 111.522 176.909 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.1 mmtp . . . . . 0 C--O 1.222 -0.354 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.32 -38.37 61.96 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 123.44 0.543 . . . . 0.0 113.372 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.3 mttm -80.15 11.84 3.22 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.943 1.697 . . . . 0.0 114.061 174.28 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.36 30.78 72.09 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.594 1.092 . . . . 0.0 113.276 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.64 163.7 40.7 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 123.507 0.575 . . . . 0.0 112.69 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -125.87 144.7 50.56 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.469 1.507 . . . . 0.0 111.115 -178.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.25 128.88 38.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 121.132 -0.98 . . . . 0.0 110.332 176.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -130.74 146.8 63.53 Favored Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 121.45 -0.781 . . . . 0.0 111.654 177.392 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -66.06 157.86 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.368 2.045 . . . . 0.0 110.428 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.3 mt -62.08 -22.2 65.58 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -77.86 -13.43 59.89 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.646 1.578 . . . . 0.0 113.078 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -87.49 135.46 33.34 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 120.429 -1.419 . . . . 0.0 110.0 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -99.94 123.51 44.26 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.238 1.415 . . . . 0.0 110.371 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -165.65 178.55 6.58 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 125.275 1.43 . . . . 0.0 109.805 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -80.42 110.42 15.85 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 121.446 -0.784 . . . . 0.0 110.302 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -121.9 133.31 54.86 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.452 1.101 . . . . 0.0 111.35 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.561 HD23 ' OE1' ' A' ' 60' ' ' GLU . 13.3 tp -88.44 133.63 34.07 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.914 -1.116 . . . . 0.0 109.344 173.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -50.3 -40.38 48.41 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.029 1.732 . . . . 0.0 113.813 172.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.6 -25.75 66.77 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.791 1.236 . . . . 0.0 112.381 176.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.561 ' OE1' HD23 ' A' ' 57' ' ' LEU . 1.1 mp0 -94.13 -28.49 15.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.233 1.013 . . . . 0.0 112.718 174.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.0 t -51.66 -38.5 55.19 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 125.658 1.583 . . . . 0.0 111.638 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.14 -44.13 67.52 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.289 1.436 . . . . 0.0 113.474 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 t -44.58 -55.96 4.73 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.138 1.775 . . . . 0.0 112.753 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 18.0 m -77.12 -58.48 3.26 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.485 172.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 36.87 -146.07 0.08 OUTLIER Glycine 0 N--CA 1.472 1.057 0 C-N-CA 128.504 2.954 . . . . 0.0 112.255 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 pttt 42.05 42.83 2.53 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 121.142 2.471 . . . . 0.0 117.174 172.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 86.26 17.05 61.47 Favored Glycine 0 CA--C 1.542 1.726 0 N-CA-C 115.36 0.904 . . . . 0.0 115.36 -174.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -142.16 152.55 43.3 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.042 2.537 . . . . 0.0 109.957 -177.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -129.09 160.84 31.54 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.842 -1.161 . . . . 0.0 109.986 176.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 47.6 t -97.91 107.41 19.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.394 0.678 . . . . 0.0 110.779 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.41 152.1 23.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.167 0.508 . . . . 0.0 110.978 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -117.93 146.8 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.093 0.957 . . . . 0.0 110.986 176.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.7 m95 . . . . . 0 N--CA 1.466 0.329 0 C-N-CA 124.112 0.965 . . . . 0.0 111.771 178.443 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 N--CA 1.469 0.515 0 N-CA-C 111.337 0.125 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -50.16 -48.22 54.02 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.409 0.683 . . . . 0.0 111.823 176.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.29 -33.91 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 124.78 1.232 . . . . 0.0 113.21 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -68.39 -28.18 66.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.138 1.375 . . . . 0.0 112.066 177.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -96.57 -5.69 38.62 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.04 40.84 28.92 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.862 0.755 . . . . 0.0 113.533 -176.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.51 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 57.0 m-85 -94.9 167.21 11.56 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.334 1.054 . . . . 0.0 112.918 172.623 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.51 127.5 7.89 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.437 1.018 . . . . 0.0 111.627 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.6 m -72.41 134.29 45.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.782 -0.834 . . . . 0.0 111.865 171.403 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 33.0 mt -142.73 163.47 38.38 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.257 175.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.504 ' HA ' HG21 ' A' ' 29' ' ' THR . 58.2 Cg_endo -68.55 137.51 39.43 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.116 2.544 . . . . 0.0 112.203 172.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -52.75 -17.1 1.17 Allowed 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -46.44 56.49 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.342 1.857 . . . . 0.0 112.041 171.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.05 -35.98 28.18 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.581 1.152 . . . . 0.0 112.107 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.5 t -87.26 109.47 25.77 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.757 -1.215 . . . . 0.0 112.08 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.06 150.66 87.64 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.933 2.422 . . . . 0.0 111.509 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -55.05 -18.38 5.22 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -78.74 -33.16 46.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.525 1.53 . . . . 0.0 112.931 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.81 -17.15 23.41 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.52 1.528 . . . . 0.0 112.666 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -51.75 109.48 0.36 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.09 0.956 . . . . 0.0 111.873 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 36.9 mt -86.03 170.54 12.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.915 0.864 . . . . 0.0 111.882 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.3 t -120.13 22.05 11.56 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.961 1.305 . . . . 0.0 112.224 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.51 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 60.4 m-85 -70.29 -19.68 63.08 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 175.747 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.26 73.04 0.5 Allowed Glycine 0 N--CA 1.471 0.985 0 O-C-N 120.608 -1.308 . . . . 0.0 113.684 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -167.02 30.19 0.19 Allowed Glycine 0 N--CA 1.464 0.507 0 O-C-N 120.407 -1.643 . . . . 0.0 114.163 -176.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 59.9 m -130.55 163.22 27.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.195 0.998 . . . . 0.0 112.109 178.159 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.0 m -59.08 -31.43 68.88 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.837 1.255 . . . . 0.0 113.198 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.504 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.6 t -144.75 -55.22 0.33 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.605 1.162 . . . . 0.0 111.933 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 29' ' ' THR . 5.3 p -146.27 151.24 14.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-O 122.357 1.075 . . . . 0.0 110.945 174.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 14.2 m -87.83 139.11 30.85 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.233 1.013 . . . . 0.0 108.646 170.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.4 136.52 53.12 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.669 0.788 . . . . 0.0 112.042 174.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -78.49 102.77 8.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.849 0.833 . . . . 0.0 111.672 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.9 mt -58.34 -38.2 76.68 Favored 'General case' 0 C--O 1.221 -0.44 0 O-C-N 121.686 -0.634 . . . . 0.0 111.642 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.469 0.488 0 C-N-CA 124.343 1.057 . . . . 0.0 111.819 178.606 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -78.83 -27.05 57.43 Favored Glycine 0 CA--C 1.535 1.302 0 O-C-N 121.309 -0.87 . . . . 0.0 114.91 -173.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.78 9.08 12.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.187 2.595 . . . . 0.0 112.713 173.263 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 83.58 31.21 27.86 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.617 1.58 . . . . 0.0 114.206 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -113.79 179.91 18.93 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.332 1.066 . . . . 0.0 113.112 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -150.52 157.13 42.66 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.807 0.843 . . . . 0.0 111.152 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.0 t -63.5 126.86 28.88 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.046 -1.034 . . . . 0.0 110.807 174.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -124.92 152.89 70.75 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.17 0.988 . . . . 0.0 111.357 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.18 156.76 46.68 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.356 2.037 . . . . 0.0 111.524 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.0 mt -62.52 -24.42 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 178.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -71.8 -19.52 61.99 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.891 1.276 . . . . 0.0 113.747 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -79.24 127.47 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.981 -1.074 . . . . 0.0 110.522 173.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -91.13 117.62 29.76 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.715 0.806 . . . . 0.0 111.498 172.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.66 174.39 10.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.988 176.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 tptt -72.93 124.68 25.92 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.44 -0.788 . . . . 0.0 109.236 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -123.79 142.16 51.36 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 124.808 1.243 . . . . 0.0 110.214 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.75 152.36 19.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.852 0.834 . . . . 0.0 110.355 174.65 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 mp0 -73.24 -38.6 65.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.389 -0.819 . . . . 0.0 110.648 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.18 58.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.317 0.647 . . . . 0.0 112.638 177.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -82.48 -43.16 17.55 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.909 0.884 . . . . 0.0 111.111 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.2 p -58.25 -31.88 67.82 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.959 -1.713 . . . . 0.0 112.096 178.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.75 -38.24 64.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.975 1.31 . . . . 0.0 113.341 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -57.96 -49.14 77.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.72 1.608 . . . . 0.0 114.107 -176.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 m -75.73 -59.16 2.87 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 169.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 38.8 -143.6 0.3 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 126.077 1.799 . . . . 0.0 112.017 -175.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? 48.23 35.56 5.63 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.02 1.859 . . . . 0.0 116.02 171.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.26 21.19 42.4 Favored Glycine 0 CA--C 1.538 1.486 0 N-CA-C 115.174 0.83 . . . . 0.0 115.174 -172.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -136.78 157.0 47.77 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.342 2.257 . . . . 0.0 111.373 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -134.49 142.17 46.97 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.399 1.88 . . . . 0.0 109.724 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.4 m -86.8 115.45 24.23 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 120.823 -1.173 . . . . 0.0 110.015 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 18.3 m -110.41 152.1 26.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.449 0.642 . . . . 0.0 112.155 176.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.2 p -123.66 143.9 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.601 0.761 . . . . 0.0 110.475 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.5 m95 . . . . . 0 CA--C 1.541 0.633 0 C-N-CA 124.465 1.106 . . . . 0.0 110.939 175.015 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.588 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 86.0 m -51.96 -46.71 64.88 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.514 1.126 . . . . 0.0 111.4 176.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.81 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.799 1.24 . . . . 0.0 112.023 176.077 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.2 t -67.63 -23.89 65.4 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.242 1.017 . . . . 0.0 112.093 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.444 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.3 OUTLIER -99.32 -2.12 37.19 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 171.802 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.18 31.92 58.93 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 118.578 -1.124 . . . . 0.0 113.179 -178.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 45.4 m-85 -88.01 166.74 14.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.275 1.43 . . . . 0.0 112.636 174.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.11 129.25 8.01 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 125.021 1.296 . . . . 0.0 110.835 -178.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.4 m -69.16 124.8 24.77 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.066 0.546 . . . . 0.0 111.578 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 mt -131.57 162.73 54.39 Favored Pre-proline 0 CA--C 1.538 0.507 0 O-C-N 124.084 0.865 . . . . 0.0 110.861 174.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.47 138.51 35.73 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 123.003 2.468 . . . . 0.0 110.576 172.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -52.51 -18.38 1.67 Allowed 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.1 t -74.5 -45.33 46.61 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.63 1.972 . . . . 0.0 112.533 171.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -74.99 -43.16 55.51 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.357 1.063 . . . . 0.0 110.971 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.7 t -84.82 119.23 72.48 Favored Pre-proline 0 C--O 1.242 0.698 0 C-N-CA 123.348 0.659 . . . . 0.0 111.906 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.4 148.23 92.86 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.471 2.114 . . . . 0.0 110.869 -178.529 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -49.98 -28.08 6.33 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 173.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.02 -32.84 67.54 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 174.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.38 -17.87 26.49 Favored 'General case' 0 N--CA 1.46 0.064 0 C-N-CA 125.349 1.46 . . . . 0.0 113.539 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.417 ' HG2' HG21 ' A' ' 30' ' ' VAL . 90.4 mtt180 -51.72 105.91 0.13 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.479 -0.763 . . . . 0.0 111.443 173.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' ' 31' ' ' CYS . 47.3 mt -84.64 167.33 16.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.487 1.137 . . . . 0.0 111.194 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 p -116.59 18.18 15.09 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.822 1.649 . . . . 0.0 112.426 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.588 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 51.2 m-85 -66.93 -9.21 35.81 Favored 'General case' 0 C--O 1.211 -0.921 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.17 57.37 19.5 Favored Glycine 0 N--CA 1.472 1.095 0 O-C-N 120.444 -1.41 . . . . 0.0 113.098 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -147.22 23.55 1.57 Allowed Glycine 0 C--O 1.226 -0.404 0 CA-C-O 118.767 -1.018 . . . . 0.0 115.575 -172.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 58.8 m -141.39 143.6 34.04 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.216 1.006 . . . . 0.0 111.134 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.3 m -50.24 -43.87 53.17 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.837 1.255 . . . . 0.0 113.37 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.52 -73.49 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.508 1.923 . . . . 0.0 110.509 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.417 HG21 ' HG2' ' A' ' 21' ' ' ARG . 9.4 p -148.09 153.8 11.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 123.839 0.856 . . . . 0.0 111.015 177.108 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 88.1 m -91.53 133.94 35.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.64 138.62 45.73 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.762 1.225 . . . . 0.0 112.038 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.4 95.95 7.2 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 122.912 1.339 . . . . 0.0 114.415 178.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.15 -37.31 86.7 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 120.718 -1.239 . . . . 0.0 110.927 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.47 0.544 0 O-C-N 120.008 -1.683 . . . . 0.0 113.263 179.572 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.584 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.95 -37.43 60.57 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.567 1.08 . . . . 0.0 112.226 -178.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -80.28 8.09 8.17 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.099 1.36 . . . . 0.0 113.809 174.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.68 19.27 52.44 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.195 1.379 . . . . 0.0 114.069 -177.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.39 150.26 26.97 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 125.138 1.351 . . . . 0.0 112.77 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -140.55 145.65 37.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 124.657 1.183 . . . . 0.0 110.322 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 91.4 m -71.77 114.3 9.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.522 0.729 . . . . 0.0 111.912 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -117.33 148.72 43.24 Favored Pre-proline 0 C--O 1.241 0.618 0 C-N-CA 124.172 0.989 . . . . 0.0 110.581 -179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.79 152.7 77.22 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 121.86 1.706 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.3 mt -60.61 -18.4 52.87 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.56 -24.27 56.66 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.049 1.739 . . . . 0.0 112.844 171.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -78.26 143.29 37.18 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 119.961 -1.712 . . . . 0.0 110.582 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -102.75 120.72 41.09 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 124.535 1.134 . . . . 0.0 111.371 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.6 p -169.5 173.23 6.57 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.236 1.414 . . . . 0.0 110.943 175.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -76.0 102.26 5.57 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.89 1.276 . . . . 0.0 110.955 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -118.73 139.64 51.23 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.49 1.116 . . . . 0.0 110.342 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 17.8 mt -87.92 126.31 34.98 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 123.106 0.563 . . . . 0.0 110.171 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -60.62 -39.35 87.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.335 0.654 . . . . 0.0 111.816 -178.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.34 -26.57 58.69 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.117 0.967 . . . . 0.0 113.023 175.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -88.67 -22.33 23.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.225 1.01 . . . . 0.0 112.327 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.8 p -54.91 -29.3 55.72 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.968 1.707 . . . . 0.0 112.708 175.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.64 49.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.328 1.451 . . . . 0.0 113.053 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.1 m -55.23 -42.77 73.85 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 174.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 73.8 m -80.37 -36.62 33.72 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.821 0.448 . . . . 0.0 111.678 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 110.36 170.39 19.75 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 122.954 1.308 . . . . 0.0 112.514 179.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -56.26 134.87 53.59 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.749 -1.442 . . . . 0.0 111.092 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.13 5.4 65.85 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.977 -0.902 . . . . 0.0 114.054 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -140.99 163.63 32.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.843 2.057 . . . . 0.0 110.225 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -123.9 162.05 24.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.76 1.624 . . . . 0.0 110.151 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -123.7 97.48 5.4 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.566 0.747 . . . . 0.0 110.95 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 93.8 m -97.72 138.67 34.76 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.338 1.055 . . . . 0.0 110.157 -178.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -105.17 145.76 13.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 124.136 0.974 . . . . 0.0 111.369 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.7 m95 . . . . . 0 C--N 1.327 -0.379 0 CA-C-O 122.139 0.971 . . . . 0.0 110.839 177.621 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -110.13 -33.03 6.79 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.004 0.43 . . . . 0.0 110.575 -175.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -49.6 -58.28 5.55 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.985 0.914 . . . . 0.0 111.477 177.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.63 -31.22 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.322 0.649 . . . . 0.0 112.438 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.67 -29.45 69.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.636 1.174 . . . . 0.0 111.318 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 2.1 mmmp? -96.7 -9.53 28.87 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 117.286 -1.34 . . . . 0.0 114.169 174.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 84.25 34.42 17.38 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 125.107 1.504 . . . . 0.0 112.541 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.524 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 59.1 m-85 -87.58 170.53 11.23 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.985 1.314 . . . . 0.0 112.574 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.72 123.9 5.85 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.794 -0.923 . . . . 0.0 110.794 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -74.26 131.59 41.33 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 118.799 -0.62 . . . . 0.0 111.252 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 mt -144.72 160.67 46.54 Favored Pre-proline 0 CA--C 1.53 0.199 0 O-C-N 124.075 0.859 . . . . 0.0 111.071 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.624 ' HA ' HG21 ' A' ' 29' ' ' THR . 55.4 Cg_endo -67.07 137.73 45.25 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.484 2.789 . . . . 0.0 110.913 174.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.497 ' HA ' HG11 ' A' ' 30' ' ' VAL . 66.9 mt-30 -52.08 -23.17 4.9 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 175.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 t -70.38 -46.44 64.06 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 124.257 1.023 . . . . 0.0 113.208 171.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -72.85 -41.17 65.06 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.957 0.903 . . . . 0.0 110.197 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.1 t -85.38 124.44 71.69 Favored Pre-proline 0 CA--C 1.541 0.622 0 O-C-N 120.591 -1.318 . . . . 0.0 111.715 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -62.71 145.73 95.05 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.696 2.264 . . . . 0.0 110.494 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -52.87 -21.33 4.14 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.72 -34.08 40.35 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.671 1.588 . . . . 0.0 112.62 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.61 -25.14 28.79 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 117.881 -1.056 . . . . 0.0 112.481 177.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -49.18 111.35 0.47 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.176 0.898 . . . . 0.0 110.933 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.7 mt -93.8 174.71 7.04 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.725 0.774 . . . . 0.0 109.879 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 m -115.14 25.24 11.03 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.009 1.324 . . . . 0.0 111.86 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.524 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 52.0 m-85 -67.93 -11.72 59.3 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.865 175.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 45.0 80.42 0.05 OUTLIER Glycine 0 N--CA 1.473 1.166 0 CA-C-N 120.882 1.673 . . . . 0.0 114.404 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 177.64 27.73 0.04 OUTLIER Glycine 0 C--O 1.226 -0.355 0 O-C-N 120.643 -1.504 . . . . 0.0 113.401 -174.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.7 m -125.89 159.26 33.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.762 0.825 . . . . 0.0 110.872 176.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.4 p -43.18 -43.58 4.73 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.463 1.105 . . . . 0.0 112.899 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.624 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.3 t -137.81 -61.82 0.61 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.963 1.705 . . . . 0.0 111.311 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.542 ' H ' HG23 ' A' ' 29' ' ' THR . 7.8 p -138.57 151.62 24.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 122.132 0.968 . . . . 0.0 110.387 179.028 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -90.76 134.1 34.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.26 173.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.81 141.26 41.09 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.113 0.965 . . . . 0.0 111.826 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -81.32 103.19 10.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.46 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.4 mt -63.61 -32.71 74.26 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 121.063 -1.023 . . . . 0.0 110.825 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.5 t -64.93 -29.61 70.56 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 119.352 -2.093 . . . . 0.0 112.709 176.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -86.67 -36.1 18.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.538 0.735 . . . . 0.0 112.924 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -88.42 -65.34 1.03 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 124.109 0.964 . . . . 0.0 110.14 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.6 t -173.06 139.52 0.83 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.8 1.24 . . . . 0.0 112.432 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -114.05 29.5 7.68 Favored Glycine 0 C--O 1.229 -0.193 0 CA-C-O 117.274 -1.848 . . . . 0.0 112.181 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.5 t -50.95 -38.4 50.28 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 119.028 1.414 . . . . 0.0 110.633 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -72.18 -49.29 36.75 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.033 0.933 . . . . 0.0 112.831 178.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.71 -34.98 79.44 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-O 119.695 -0.503 . . . . 0.0 113.354 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -80.07 14.82 1.7 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.627 1.171 . . . . 0.0 113.781 173.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.05 45.15 52.36 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 123.791 0.71 . . . . 0.0 113.265 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -124.43 159.66 19.05 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.594 1.568 . . . . 0.0 112.764 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -147.51 153.55 39.65 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.676 1.227 . . . . 0.0 111.477 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.2 m -64.34 124.31 21.41 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.927 -1.108 . . . . 0.0 112.507 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -122.64 147.97 51.96 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-O 122.019 0.914 . . . . 0.0 111.258 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.23 153.24 71.68 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.212 1.941 . . . . 0.0 110.416 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.641 HD22 ' HE3' ' A' ' 69' ' ' LYS . 21.5 mt -60.08 -22.06 62.25 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 175.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.66 -18.59 60.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.015 1.326 . . . . 0.0 112.591 175.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.9 tpp85 -87.27 127.66 35.17 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.454 176.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.03 119.38 19.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.742 175.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.2 t -165.69 176.05 8.34 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.214 1.006 . . . . 0.0 110.401 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -96.91 110.45 22.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.779 1.231 . . . . 0.0 110.466 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -111.01 138.12 47.81 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.455 1.102 . . . . 0.0 110.727 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 13.2 mt -89.16 153.2 21.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.455 -0.778 . . . . 0.0 110.433 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -63.92 -36.28 83.41 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.416 -0.802 . . . . 0.0 112.102 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.1 50.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.486 0.714 . . . . 0.0 112.285 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -81.24 -33.61 32.7 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.2 m -56.27 -31.46 63.62 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.051 -1.031 . . . . 0.0 112.16 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -40.08 70.11 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.338 1.055 . . . . 0.0 112.746 175.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -48.0 -58.64 4.17 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.423 1.489 . . . . 0.0 111.938 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.7 m -64.36 -49.64 70.86 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.593 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.13 -169.68 12.97 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-O 123.097 1.387 . . . . 0.0 112.759 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -64.94 136.74 57.18 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.713 -1.463 . . . . 0.0 111.73 177.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.05 5.33 89.33 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 119.328 -0.707 . . . . 0.0 113.56 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -136.89 161.14 36.82 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.734 1.214 . . . . 0.0 110.951 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.641 ' HE3' HD22 ' A' ' 50' ' ' LEU . 43.9 mttt -138.47 121.4 16.61 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.759 1.224 . . . . 0.0 110.659 -178.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.6 t -73.8 106.92 5.74 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.7 -0.625 . . . . 0.0 111.048 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.457 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.9 OUTLIER -91.21 151.84 20.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.402 0.62 . . . . 0.0 110.662 177.153 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.75 145.48 34.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 124.209 1.003 . . . . 0.0 110.601 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.457 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 47.2 m95 -113.72 179.91 3.82 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 121.569 0.699 . . . . 0.0 111.51 175.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.68 ' H ' HD23 ' A' ' 74' ' ' LEU . 1.6 pt? -76.39 34.69 0.14 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 174.12 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 116.578 -1.677 . . . . 0.0 111.809 -179.722 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 118.973 -0.537 . . . . 0.0 109.687 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.72 -30.74 8.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.732 -171.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.554 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 63.3 m -51.5 -56.61 12.44 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.743 1.217 . . . . 0.0 110.201 176.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.18 -32.06 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.532 1.133 . . . . 0.0 113.827 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.5 t -61.23 -33.73 73.97 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.063 1.345 . . . . 0.0 111.37 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -96.03 -5.82 40.17 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 82.61 30.06 34.0 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-O 117.695 -1.614 . . . . 0.0 113.347 -177.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -75.11 168.66 19.56 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.458 1.629 . . . . 0.0 112.936 174.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.81 114.63 3.17 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.293 1.425 . . . . 0.0 111.435 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.5 m -66.04 131.45 46.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.748 172.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.418 ' O ' HG13 ' A' ' 30' ' ' VAL . 51.8 mt -145.11 155.63 54.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 124.04 0.838 . . . . 0.0 111.496 176.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.499 ' HA ' HG21 ' A' ' 29' ' ' THR . 58.2 Cg_endo -63.43 138.27 64.66 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.509 2.139 . . . . 0.0 110.587 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -25.55 1.99 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 p -71.09 -41.17 70.98 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.998 0.919 . . . . 0.0 112.921 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -78.91 -46.22 18.92 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.822 1.649 . . . . 0.0 111.567 176.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.3 t -88.08 121.67 70.41 Favored Pre-proline 0 C--O 1.244 0.799 0 C-N-CA 124.142 0.977 . . . . 0.0 111.485 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -61.47 144.5 98.06 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.74 2.293 . . . . 0.0 110.5 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.2 pp0? -47.38 -30.12 3.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.214 1.006 . . . . 0.0 113.688 175.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -69.7 -32.97 71.87 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.962 1.305 . . . . 0.0 113.739 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.67 -20.42 21.62 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.749 1.22 . . . . 0.0 112.506 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.518 ' HG2' HG21 ' A' ' 30' ' ' VAL . 73.5 mtt180 -51.1 100.34 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 112.272 173.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 41.9 mt -84.28 166.41 17.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.967 0.889 . . . . 0.0 111.214 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -113.79 29.3 8.1 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.184 1.794 . . . . 0.0 112.277 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.554 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 15.2 m-85 -68.17 -17.95 64.48 Favored 'General case' 0 C--O 1.211 -0.944 0 O-C-N 121.255 -0.903 . . . . 0.0 112.57 175.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.1 74.38 0.41 Allowed Glycine 0 N--CA 1.473 1.11 0 CA-C-O 123.767 1.759 . . . . 0.0 113.29 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.73 36.54 0.07 OUTLIER Glycine 0 C--O 1.224 -0.47 0 O-C-N 120.691 -1.476 . . . . 0.0 112.299 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 53.3 m -134.75 160.95 36.57 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 117.012 0.406 . . . . 0.0 111.545 170.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.8 m -54.68 -37.61 65.98 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.121 0.969 . . . . 0.0 112.966 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -135.44 -56.34 0.79 Allowed 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.279 1.432 . . . . 0.0 110.382 -179.474 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.518 HG21 ' HG2' ' A' ' 21' ' ' ARG . 2.4 p -152.76 145.49 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.992 0.917 . . . . 0.0 111.898 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 61.2 m -86.2 134.33 33.79 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.091 172.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.62 146.59 29.48 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.108 0.963 . . . . 0.0 110.962 172.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -86.21 107.35 17.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.723 0.809 . . . . 0.0 112.05 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.34 -29.56 70.54 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.469 -0.77 . . . . 0.0 111.704 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.4 m -72.29 -18.31 61.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 119.818 -1.801 . . . . 0.0 113.087 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.9 mmtt -96.46 -38.06 10.17 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.637 1.175 . . . . 0.0 111.878 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 37' ' ' LEU . 2.7 mm? -87.82 -68.87 0.73 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.351 1.06 . . . . 0.0 110.33 177.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.422 HG21 ' OE2' ' A' ' 60' ' ' GLU . 14.9 t -166.6 136.63 3.17 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 123.599 1.666 . . . . 0.0 112.769 -174.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -102.45 24.52 30.69 Favored Glycine 0 C--O 1.222 -0.605 0 CA-C-O 116.177 -2.457 . . . . 0.0 113.965 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.4 t -46.85 -62.99 1.14 Allowed 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 121.27 2.535 . . . . 0.0 111.006 -172.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -33.37 52.76 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 174.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.18 65.92 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-N 118.261 0.482 . . . . 0.0 113.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -88.75 12.27 15.41 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.015 1.726 . . . . 0.0 113.52 173.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.47 40.47 9.92 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.691 1.139 . . . . 0.0 112.411 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.14 165.02 31.33 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 121.566 0.537 . . . . 0.0 113.578 174.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -146.93 154.61 41.48 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.912 1.285 . . . . 0.0 112.081 -176.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.0 t -73.28 127.14 31.79 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.716 -1.24 . . . . 0.0 110.604 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -126.33 149.93 68.66 Favored Pre-proline 0 CA--C 1.543 0.695 0 C-N-CA 123.607 0.763 . . . . 0.0 111.074 -178.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.28 158.91 55.51 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.524 2.15 . . . . 0.0 111.744 176.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.421 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 16.0 mt -61.71 -19.79 62.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.525 0.73 . . . . 0.0 112.935 176.087 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -80.99 -15.41 56.29 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.004 2.122 . . . . 0.0 112.618 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -87.12 137.33 32.44 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 120.962 -1.087 . . . . 0.0 109.718 174.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.6 120.41 28.89 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.793 1.237 . . . . 0.0 111.075 172.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.13 -177.91 5.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.003 0.921 . . . . 0.0 110.361 174.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.62 112.51 22.39 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.357 -0.839 . . . . 0.0 110.404 170.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.28 133.03 50.21 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.308 1.443 . . . . 0.0 113.02 177.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mt -87.52 154.77 20.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 120.435 -1.416 . . . . 0.0 110.265 177.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -68.3 -36.79 79.87 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.92 -37.56 67.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.062 0.545 . . . . 0.0 110.993 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.422 ' OE2' HG21 ' A' ' 38' ' ' THR . 23.8 mm-40 -75.99 -30.5 58.58 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -177.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.1 t -49.08 -44.77 42.29 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.273 0.629 . . . . 0.0 112.179 171.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.62 -38.75 72.51 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.511 -0.757 . . . . 0.0 112.978 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.6 t -51.11 -44.75 61.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.527 1.531 . . . . 0.0 112.725 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.8 m -68.4 -60.29 2.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.409 0.684 . . . . 0.0 112.152 172.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 136.55 -156.73 23.26 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 122.387 0.993 . . . . 0.0 113.816 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -80.88 133.14 35.52 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.762 -1.434 . . . . 0.0 111.574 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.24 10.0 84.29 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 123.916 0.77 . . . . 0.0 114.381 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -137.56 155.14 49.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.013 1.325 . . . . 0.0 109.948 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 19.3 mmtp -136.26 131.04 33.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.503 1.921 . . . . 0.0 109.437 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.4 t -73.56 111.04 8.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.404 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 40.5 m -106.21 161.29 14.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.557 0.694 . . . . 0.0 111.724 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p -129.59 144.16 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 123.556 0.743 . . . . 0.0 111.121 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -101.53 -178.73 3.81 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 122.484 1.135 . . . . 0.0 111.008 174.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.7 mp -57.69 110.83 0.96 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.094 0.957 . . . . 0.0 108.955 168.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.253 1.264 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 171.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.483 1.188 0 CA-C-O 119.035 -0.507 . . . . 0.0 109.886 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -121.69 -41.3 2.48 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.809 0.338 . . . . 0.0 111.34 -172.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.634 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 87.4 m -50.83 -51.26 52.85 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.093 -1.004 . . . . 0.0 111.109 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -59.33 -32.35 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.202 1.001 . . . . 0.0 113.302 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.4 t -67.04 -29.07 68.77 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.66 1.584 . . . . 0.0 111.309 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.434 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 35.1 mmtt -94.31 -5.59 46.32 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 172.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.08 37.22 25.74 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-O 118.293 -1.282 . . . . 0.0 112.947 -177.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.43 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 43.1 m-85 -98.87 161.53 13.58 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.636 1.975 . . . . 0.0 112.216 174.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.72 130.49 9.12 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.303 0.954 . . . . 0.0 111.528 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.3 134.2 48.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 118.105 -0.95 . . . . 0.0 111.939 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.2 mt -145.39 156.15 53.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 O-C-N 123.741 0.651 . . . . 0.0 110.986 175.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -66.81 140.08 54.34 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.377 2.052 . . . . 0.0 110.4 174.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -49.4 -23.58 1.57 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 174.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 p -70.78 -44.48 66.57 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.651 1.18 . . . . 0.0 112.698 173.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -79.67 -42.22 25.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.923 1.689 . . . . 0.0 111.766 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.5 t -89.73 122.22 68.28 Favored Pre-proline 0 C--O 1.245 0.865 0 C-N-CA 124.525 1.13 . . . . 0.0 111.847 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.18 146.73 94.27 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.866 2.377 . . . . 0.0 110.85 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -51.39 -29.08 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -70.2 -24.65 63.16 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.67 -17.53 17.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.446 1.899 . . . . 0.0 113.984 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.506 ' HG2' HG21 ' A' ' 30' ' ' VAL . 85.4 mtt180 -57.11 101.33 0.06 Allowed 'General case' 0 N--CA 1.463 0.186 0 O-C-N 121.307 -0.871 . . . . 0.0 111.113 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 33' ' ' ASP . 53.8 mt -85.21 168.12 15.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 122.406 1.098 . . . . 0.0 110.815 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -120.59 30.6 6.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.428 1.891 . . . . 0.0 112.403 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.634 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 38.6 m-85 -67.46 -16.48 64.24 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 121.535 -0.728 . . . . 0.0 112.667 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.07 67.07 2.14 Favored Glycine 0 N--CA 1.469 0.897 0 CA-C-N 119.825 1.193 . . . . 0.0 112.831 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -164.34 25.24 0.18 Allowed Glycine 0 N--CA 1.462 0.426 0 O-C-N 120.983 -1.304 . . . . 0.0 114.276 -177.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 55.4 m -132.39 151.03 52.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.866 0.866 . . . . 0.0 111.541 175.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.9 m -53.36 -41.82 66.21 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.191 0.997 . . . . 0.0 112.941 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.0 -72.64 0.68 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.993 1.717 . . . . 0.0 109.581 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.506 HG21 ' HG2' ' A' ' 21' ' ' ARG . 3.3 p -143.97 140.62 25.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.413 1.085 . . . . 0.0 111.227 -177.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 97.4 m -79.8 137.89 37.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.043 -1.036 . . . . 0.0 109.477 172.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.66 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -110.67 133.22 53.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.349 1.06 . . . . 0.0 111.766 172.015 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.658 ' HB3' HD11 ' A' ' 22' ' ' LEU . 1.1 p30 -80.27 97.22 6.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 123.436 1.589 . . . . 0.0 113.937 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 mt -59.24 -41.26 88.29 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 119.785 -1.822 . . . . 0.0 110.955 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m -62.76 -34.56 77.47 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 mtpt -80.86 -38.51 28.01 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 118.017 -0.992 . . . . 0.0 112.164 176.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.66 HD11 ' SG ' ' A' ' 32' ' ' CYS . 46.0 mt -60.91 -61.37 2.63 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 124.334 1.054 . . . . 0.0 111.15 176.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.4 t -159.62 143.18 14.47 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 122.561 1.172 . . . . 0.0 110.891 -178.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -70.99 23.98 0.54 Allowed Glycine 0 CA--C 1.531 1.065 0 CA-C-O 115.697 -2.724 . . . . 0.0 115.282 176.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.4 t -42.75 -66.43 0.37 Allowed 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 121.611 2.705 . . . . 0.0 111.394 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.68 -36.68 50.99 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 176.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.74 -27.98 69.24 Favored Glycine 0 CA--C 1.534 1.245 0 CA-C-O 119.358 -0.69 . . . . 0.0 112.978 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -86.27 13.25 8.32 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.391 2.276 . . . . 0.0 113.318 173.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.34 37.16 54.53 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-N 118.252 0.478 . . . . 0.0 113.055 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.14 162.18 13.19 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 125.639 1.59 . . . . 0.0 113.466 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -142.95 150.12 39.29 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 124.756 1.222 . . . . 0.0 109.894 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 96.5 m -61.89 114.46 3.37 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.388 -0.82 . . . . 0.0 111.8 174.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -116.14 148.23 41.06 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.521 1.128 . . . . 0.0 111.015 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.48 152.26 78.85 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.774 2.316 . . . . 0.0 111.186 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.5 mt -60.75 -20.92 62.38 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.98 -20.26 59.74 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.528 1.531 . . . . 0.0 112.468 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -86.03 128.17 34.81 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 120.781 -1.199 . . . . 0.0 109.959 176.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.82 118.87 23.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.493 0.717 . . . . 0.0 110.926 174.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.19 173.86 11.89 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.516 1.126 . . . . 0.0 110.354 176.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.3 ttmt -82.33 114.32 20.72 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.84 129.77 51.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.608 1.563 . . . . 0.0 112.316 177.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 21.9 tp -85.47 136.08 33.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 120.642 -1.286 . . . . 0.0 110.067 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -54.12 -38.1 65.06 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.695 -1.253 . . . . 0.0 113.982 172.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.48 -33.53 74.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.025 0.93 . . . . 0.0 110.546 177.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -79.32 -33.02 43.51 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.232 1.013 . . . . 0.0 112.206 178.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.41 ' CB ' ' HD3' ' A' ' 69' ' ' LYS . 24.7 p -55.07 -28.86 55.54 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.224 1.01 . . . . 0.0 113.477 176.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.84 -35.26 77.73 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.404 1.082 . . . . 0.0 112.851 174.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.8 t -56.48 -45.54 80.88 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.877 1.271 . . . . 0.0 112.179 178.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 66.6 m -74.91 -43.11 56.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.299 0.64 . . . . 0.0 112.512 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 114.93 -146.75 18.86 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 122.414 1.008 . . . . 0.0 112.586 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -87.62 147.04 25.46 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.116 -1.226 . . . . 0.0 111.947 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.87 6.92 74.25 Favored Glycine 0 CA--C 1.538 1.51 0 N-CA-C 114.272 0.469 . . . . 0.0 114.272 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -138.51 153.45 48.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.486 1.514 . . . . 0.0 109.754 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.41 ' HD3' ' CB ' ' A' ' 61' ' ' SER . 14.8 mmtp -134.14 125.49 28.02 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 126.252 1.821 . . . . 0.0 110.179 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.56 107.81 7.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 118.988 -0.529 . . . . 0.0 110.584 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 24.9 m -98.4 157.5 16.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 123.147 0.579 . . . . 0.0 111.94 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.1 t -106.0 138.08 33.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 110.9 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.6 m95 -104.97 -56.96 2.09 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 114.881 1.438 . . . . 0.0 114.881 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.2 mp -52.03 122.71 8.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.491 0.717 . . . . 0.0 109.496 175.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 42.0 m80 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 116.3 -1.809 . . . . 0.0 111.205 177.814 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -111.58 -29.65 7.66 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.436 0.636 . . . . 0.0 110.56 -177.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -54.82 -58.77 6.23 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.303 -0.873 . . . . 0.0 111.348 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.2 p -58.01 -33.46 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 m -63.12 -28.57 70.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.217 1.007 . . . . 0.0 111.077 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.4 mmmp? -96.57 -10.59 26.89 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 173.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.52 36.73 7.86 Favored Glycine 0 CA--C 1.52 0.404 0 CA-C-O 118.488 -1.173 . . . . 0.0 112.097 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -97.41 165.44 12.01 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.763 1.282 . . . . 0.0 111.786 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.86 131.69 10.09 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 111.273 -0.731 . . . . 0.0 111.273 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.8 m -79.4 123.74 27.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 O-C-N 122.085 -0.656 . . . . 0.0 110.791 176.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.474 ' O ' HG12 ' A' ' 30' ' ' VAL . 31.9 mt -138.62 155.01 73.7 Favored Pre-proline 0 C--O 1.218 -0.602 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.725 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -63.77 139.79 70.7 Favored 'Trans proline' 0 C--O 1.219 -0.44 0 C-N-CA 124.333 3.355 . . . . 0.0 110.488 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.443 ' HA ' HG11 ' A' ' 30' ' ' VAL . 28.3 mp0 -51.62 -26.98 9.95 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 176.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 m -65.57 -46.81 78.05 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.893 0.877 . . . . 0.0 113.155 170.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -75.97 -36.59 59.2 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.509 0.723 . . . . 0.0 112.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.4 t -89.24 121.37 69.52 Favored Pre-proline 0 C--O 1.241 0.632 0 O-C-N 121.089 -1.007 . . . . 0.0 111.823 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -62.96 146.96 95.03 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.651 2.234 . . . . 0.0 110.545 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -52.05 -19.72 2.04 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.91 -32.54 27.21 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.637 1.175 . . . . 0.0 113.052 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.81 -20.58 25.89 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.078 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HD3' HG21 ' A' ' 30' ' ' VAL . 60.0 mtt180 -55.24 119.27 5.28 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.429 0.692 . . . . 0.0 110.078 175.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.0 mt -102.71 175.92 5.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.791 0.805 . . . . 0.0 110.272 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.3 29.85 7.55 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.26 1.024 . . . . 0.0 111.593 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -67.93 -18.36 64.74 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 121.341 -0.849 . . . . 0.0 111.914 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.89 49.97 67.26 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 120.734 -1.229 . . . . 0.0 112.441 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -142.7 33.65 1.85 Allowed Glycine 0 C--O 1.225 -0.458 0 CA-C-O 118.032 -1.427 . . . . 0.0 113.5 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -142.44 150.54 40.72 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.107 0.963 . . . . 0.0 111.777 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.1 m -58.67 -45.56 89.12 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 123.765 0.666 . . . . 0.0 111.416 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 58.4 p -105.66 -75.79 0.62 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.222 0.609 . . . . 0.0 109.594 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.572 HG21 ' HD3' ' A' ' 21' ' ' ARG . 7.7 p -148.16 148.0 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 126.014 1.726 . . . . 0.0 110.49 179.117 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.85 131.34 35.85 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.127 -0.983 . . . . 0.0 110.891 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.22 139.11 45.73 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.384 1.074 . . . . 0.0 111.737 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -81.09 101.2 9.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.808 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.47 -19.42 64.72 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.246 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.0 t -68.69 -38.16 80.1 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 120.105 1.32 . . . . 0.0 112.336 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.1 mtmt -88.39 -36.56 16.48 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 122.792 0.437 . . . . 0.0 112.014 177.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 37' ' ' LEU . 1.9 mm? -71.87 -47.88 49.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 123.086 0.554 . . . . 0.0 111.628 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 79.0 p -130.64 -175.02 3.52 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 122.442 1.115 . . . . 0.0 111.076 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -125.56 -41.42 0.35 Allowed Glycine 0 C--O 1.221 -0.682 0 CA-C-O 118.057 -1.413 . . . . 0.0 112.369 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.7 t -44.86 -50.38 10.38 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.536 1.168 . . . . 0.0 111.709 -177.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -64.06 -47.47 80.04 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 123.84 0.856 . . . . 0.0 112.99 176.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.1 -39.3 63.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.889 0.757 . . . . 0.0 113.083 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.0 mttm -79.31 11.92 2.66 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.444 1.098 . . . . 0.0 113.487 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.8 39.43 96.76 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.171 0.891 . . . . 0.0 112.292 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.69 172.17 46.07 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 121.954 0.752 . . . . 0.0 112.376 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -136.16 150.1 48.91 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 123.012 1.386 . . . . 0.0 112.434 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.5 t -79.17 135.69 36.88 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 120.753 -1.217 . . . . 0.0 111.662 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -133.28 148.06 67.51 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 124.061 0.944 . . . . 0.0 111.23 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.94 159.13 54.29 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.657 2.238 . . . . 0.0 110.896 177.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.421 HD11 ' HA2' ' A' ' 67' ' ' GLY . 28.7 mt -61.92 -16.73 53.08 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 175.275 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -84.61 -13.51 51.42 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 123.617 1.675 . . . . 0.0 111.963 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -92.83 130.59 38.39 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 118.783 -2.448 . . . . 0.0 110.246 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -85.12 121.55 28.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.333 176.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.496 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 1.8 t -162.1 176.44 10.69 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.903 0.881 . . . . 0.0 110.688 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.3 ttmt -94.87 108.25 20.28 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.04 0.936 . . . . 0.0 111.611 175.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.83 132.04 53.38 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.766 1.226 . . . . 0.0 111.094 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 58' ' ' GLN . 15.6 tp -77.69 137.7 38.65 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.009 -1.057 . . . . 0.0 109.593 176.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.439 ' N ' HD12 ' A' ' 57' ' ' LEU . 5.9 pt20 -53.34 -40.15 64.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.754 -1.216 . . . . 0.0 113.521 173.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.66 -24.19 63.58 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.878 0.871 . . . . 0.0 111.828 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -88.98 -31.06 18.31 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.467 1.107 . . . . 0.0 112.596 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 51.6 p -53.83 -28.04 33.28 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.828 1.251 . . . . 0.0 112.024 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.46 74.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.391 1.076 . . . . 0.0 112.332 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 m -56.93 -56.94 15.18 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.862 1.265 . . . . 0.0 111.307 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.33 -43.78 96.1 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.02 171.74 19.49 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 122.917 1.287 . . . . 0.0 112.271 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -56.58 135.41 54.71 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.464 -1.021 . . . . 0.0 110.764 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.421 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 86.28 9.87 75.45 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.852 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -144.56 169.05 18.71 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 110.795 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -131.77 156.62 45.66 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.558 1.543 . . . . 0.0 110.878 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.9 t -121.3 95.23 4.6 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.218 0.607 . . . . 0.0 111.545 -178.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.1 t -83.65 162.95 20.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -115.34 144.66 22.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 124.621 1.168 . . . . 0.0 111.213 174.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.496 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 33.3 m95 -112.85 178.3 4.33 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 122.28 1.038 . . . . 0.0 112.586 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 74' ' ' LEU . 4.1 mm? -60.85 167.41 2.83 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.011 173.293 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 16.0 p80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 114.698 -2.572 . . . . 0.0 115.148 174.718 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASN . . . . . 0.458 ' OD1' HG12 ' A' ' 4' ' ' VAL . 6.2 p30 . . . . . 0 N--CA 1.471 0.621 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -135.23 -22.66 1.53 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 122.064 0.935 . . . . 0.0 109.997 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 61.5 m -57.38 -55.27 36.93 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 120.546 -1.346 . . . . 0.0 110.83 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.458 HG12 ' OD1' ' A' ' 1' ' ' ASN . 1.0 OUTLIER -59.31 -29.65 42.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 122.606 0.363 . . . . 0.0 111.913 177.915 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -70.44 -27.88 64.59 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.687 0.795 . . . . 0.0 111.119 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 22.4 mmmt -95.5 -3.64 46.32 Favored 'General case' 0 C--N 1.338 0.106 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.7 42.25 11.64 Favored Glycine 0 C--O 1.225 -0.463 0 O-C-N 124.348 1.03 . . . . 0.0 111.323 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.496 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 38.3 m-85 -106.36 162.31 13.8 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 124.254 1.021 . . . . 0.0 111.581 176.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.49 140.68 16.21 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.879 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.9 m -79.97 117.11 20.52 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 122.885 0.474 . . . . 0.0 111.398 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.502 ' O ' HG12 ' A' ' 30' ' ' VAL . 53.2 mt -132.35 154.43 81.59 Favored Pre-proline 0 C--O 1.214 -0.791 0 O-C-N 123.576 0.547 . . . . 0.0 111.722 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -64.54 140.96 71.44 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 123.794 2.996 . . . . 0.0 110.622 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.525 ' HA ' HG11 ' A' ' 30' ' ' VAL . 65.3 mt-30 -51.2 -25.48 5.53 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 177.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 91.3 p -68.8 -46.91 67.43 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 171.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.439 ' OD2' HD22 ' A' ' 11' ' ' LEU . 28.5 t0 -72.64 -34.51 67.34 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.886 0.874 . . . . 0.0 111.911 176.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.6 t -92.84 126.65 50.82 Favored Pre-proline 0 CA--C 1.539 0.55 0 O-C-N 120.884 -1.135 . . . . 0.0 111.917 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -63.82 147.36 92.32 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.609 2.206 . . . . 0.0 110.671 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -19.53 3.71 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 172.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -81.73 -31.82 31.85 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 123.893 0.877 . . . . 0.0 112.197 175.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.89 -24.62 23.59 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -45.97 117.56 1.56 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.619 0.768 . . . . 0.0 110.376 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.4 HD11 ' HB3' ' A' ' 33' ' ' ASP . 51.7 mt -103.22 174.61 5.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.337 1.065 . . . . 0.0 109.995 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -128.1 31.46 5.07 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.732 0.813 . . . . 0.0 111.177 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.509 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 33.0 m-85 -69.0 -17.53 63.93 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 121.226 -0.921 . . . . 0.0 112.065 177.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.36 88.03 0.05 OUTLIER Glycine 0 CA--C 1.532 1.104 0 CA-C-O 124.51 2.172 . . . . 0.0 111.857 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.24 25.97 0.03 OUTLIER Glycine 0 C--O 1.224 -0.506 0 O-C-N 119.909 -1.936 . . . . 0.0 113.652 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 67.7 m -137.24 149.79 47.4 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 123.415 0.686 . . . . 0.0 111.454 177.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -61.86 -42.6 99.24 Favored 'General case' 0 C--O 1.222 -0.371 0 O-C-N 124.364 1.04 . . . . 0.0 111.291 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.5 p -107.67 -75.19 0.64 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.395 0.678 . . . . 0.0 110.245 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.525 HG11 ' HA ' ' A' ' 13' ' ' GLN . 8.4 p -151.05 143.6 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.919 1.343 . . . . 0.0 111.06 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 91.9 m -82.0 124.17 29.55 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.279 -1.513 . . . . 0.0 110.259 173.173 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.89 142.99 33.44 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 122.315 1.055 . . . . 0.0 111.407 174.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.468 ' HA ' ' CD1' ' A' ' 8' ' ' PHE . 1.9 p30 -81.03 100.71 9.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 124.247 1.975 . . . . 0.0 113.731 177.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.435 HD22 ' CD ' ' A' ' 41' ' ' LYS . 8.8 mt -65.89 -27.84 68.5 Favored 'General case' 0 C--O 1.218 -0.557 0 O-C-N 118.733 -2.479 . . . . 0.0 111.723 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.1 t -70.54 -24.26 62.77 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.3 1.04 . . . . 0.0 112.888 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -96.2 -34.39 11.67 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.469 0.708 . . . . 0.0 110.403 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.436 HD13 ' HA ' ' A' ' 37' ' ' LEU . 2.2 mm? -67.59 -56.73 8.29 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 62.0 p -146.97 -176.55 5.25 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 122.184 0.992 . . . . 0.0 112.1 -177.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -101.91 -42.42 2.27 Favored Glycine 0 C--O 1.219 -0.814 0 CA-C-O 117.993 -1.448 . . . . 0.0 112.154 177.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.4 t -41.9 -52.7 4.01 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.987 1.393 . . . . 0.0 112.377 -177.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.435 ' CD ' HD22 ' A' ' 34' ' ' LEU . 74.3 mttt -83.13 -37.6 23.53 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.777 175.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.41 -34.22 33.71 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.524 0.583 . . . . 0.0 113.958 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.6 mmtt -85.68 15.28 4.82 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.198 1.399 . . . . 0.0 113.024 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.72 36.89 93.93 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 123.735 0.683 . . . . 0.0 112.243 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.82 177.49 21.88 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 121.876 0.709 . . . . 0.0 112.192 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -142.28 152.77 43.33 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.7 1.238 . . . . 0.0 111.819 178.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.9 t -66.49 128.77 37.5 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 111.948 175.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -125.23 148.0 59.23 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 122.284 1.04 . . . . 0.0 111.793 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.04 156.23 65.86 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.287 1.992 . . . . 0.0 111.147 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.44 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 9.7 mt -65.16 -18.07 65.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 176.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -85.4 -9.6 57.33 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.402 0.681 . . . . 0.0 112.09 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -93.36 131.21 38.73 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 120.871 -1.143 . . . . 0.0 110.052 176.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -78.8 121.71 25.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.27 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.4 t -168.34 174.56 6.93 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 123.916 0.886 . . . . 0.0 110.055 176.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -92.51 124.45 36.55 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.458 1.103 . . . . 0.0 111.127 173.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -125.91 131.8 52.25 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 125.686 1.594 . . . . 0.0 110.687 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 58' ' ' GLN . 12.3 tp -91.21 135.22 33.94 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.562 -0.711 . . . . 0.0 109.808 177.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.439 ' N ' HD12 ' A' ' 57' ' ' LEU . 7.0 pt20 -51.0 -40.25 57.7 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 175.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.01 64.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.142 0.977 . . . . 0.0 111.863 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.402 ' OE1' HD23 ' A' ' 57' ' ' LEU . 1.3 mp0 -95.93 -33.53 12.15 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.67 1.188 . . . . 0.0 110.428 -178.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.1 m -53.53 -30.6 42.46 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.185 0.994 . . . . 0.0 111.37 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.87 63.42 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.82 0.848 . . . . 0.0 112.937 174.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.5 t -58.01 -58.05 10.11 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.705 0.802 . . . . 0.0 111.378 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 97.9 m -71.69 -47.25 55.42 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.964 0.412 . . . . 0.0 111.559 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -150.51 18.51 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-O 123.36 1.533 . . . . 0.0 112.38 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -78.29 145.52 35.33 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 120.249 -1.736 . . . . 0.0 111.354 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.71 0.63 85.16 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 119.31 -0.717 . . . . 0.0 113.544 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -149.21 149.31 30.77 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.219 1.007 . . . . 0.0 110.713 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.44 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -132.09 138.86 48.3 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.472 0.709 . . . . 0.0 110.29 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.5 t -77.59 131.45 37.83 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.877 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.515 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.1 OUTLIER -120.25 150.62 40.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 119.676 1.125 . . . . 0.0 110.386 177.333 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.41 141.31 46.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 123.555 0.742 . . . . 0.0 110.308 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.515 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 11.7 m95 -109.67 174.4 5.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 122.023 0.916 . . . . 0.0 111.975 175.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.443 HD12 ' OXT' ' A' ' 75' ' ' HIS . 4.0 pp -77.65 141.89 39.17 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.114 174.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.443 ' OXT' HD12 ' A' ' 74' ' ' LEU . 57.2 t-80 . . . . . 0 CA--C 1.554 1.1 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 N--CA 1.485 1.287 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -94.47 -36.75 11.74 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.462 0.476 . . . . 0.0 111.457 -174.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.7 m -51.97 -55.97 17.12 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 121.136 -0.977 . . . . 0.0 111.136 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.6 p -56.93 -34.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 175.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.0 t -63.02 -27.17 69.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.068 1.347 . . . . 0.0 112.409 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.407 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 1.0 OUTLIER -96.74 -9.7 28.39 Favored 'General case' 0 C--N 1.34 0.176 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 171.299 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 85.89 29.66 25.49 Favored Glycine 0 CA--C 1.525 0.668 0 CA-C-O 117.826 -1.541 . . . . 0.0 112.989 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.407 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 66.5 m-85 -88.81 168.88 12.09 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.065 1.433 . . . . 0.0 113.194 175.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.42 129.79 8.64 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.494 1.045 . . . . 0.0 111.623 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.2 m -77.16 132.4 38.78 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.053 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.3 mt -142.59 162.68 43.2 Favored Pre-proline 0 N--CA 1.469 0.513 0 O-C-N 124.327 1.017 . . . . 0.0 111.152 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -70.48 140.92 41.06 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.536 2.157 . . . . 0.0 111.127 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -55.4 -20.86 13.39 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.1 t -67.63 -48.47 66.64 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.902 1.281 . . . . 0.0 113.444 169.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -73.58 -44.68 56.7 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-O 123.173 1.463 . . . . 0.0 112.18 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.8 t -79.34 116.63 61.94 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 119.851 -1.78 . . . . 0.0 112.874 -178.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.67 154.12 71.08 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.012 1.808 . . . . 0.0 111.918 -177.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -28.4 22.22 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -81.68 -18.96 42.67 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.624 1.97 . . . . 0.0 113.114 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.71 -21.72 17.42 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 116.206 -1.854 . . . . 0.0 113.098 172.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -54.91 111.78 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.192 1.36 . . . . 0.0 111.335 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.589 HD21 ' HB2' ' A' ' 33' ' ' ASP . 2.6 mt -94.8 174.61 7.02 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.713 0.768 . . . . 0.0 109.921 -178.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.2 m -118.24 25.49 10.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.921 1.288 . . . . 0.0 112.675 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -66.03 -20.81 66.3 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-O 117.701 -1.143 . . . . 0.0 112.151 174.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.9 73.25 0.45 Allowed Glycine 0 N--CA 1.476 1.308 0 CA-C-N 121.107 1.776 . . . . 0.0 112.667 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -177.38 29.02 0.07 OUTLIER Glycine 0 C--O 1.23 -0.132 0 O-C-N 120.674 -1.486 . . . . 0.0 113.266 -174.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.6 m -129.58 157.75 41.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.631 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.0 t -44.19 -47.28 9.17 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.067 1.479 . . . . 0.0 112.664 -177.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -131.49 -59.3 0.97 Allowed 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.322 1.449 . . . . 0.0 110.21 177.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.4 p -140.33 153.3 21.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 122.676 1.227 . . . . 0.0 110.919 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.414 ' SG ' HD12 ' A' ' 22' ' ' LEU . 2.4 t -93.78 137.02 33.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.101 174.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.539 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.2 OUTLIER -113.17 140.09 48.21 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 122.509 1.147 . . . . 0.0 112.523 176.113 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.589 ' HB2' HD21 ' A' ' 22' ' ' LEU . 11.8 t0 -81.09 101.25 9.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.79 -1.095 . . . . 0.0 111.523 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -62.64 -37.92 88.24 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.644 -1.17 . . . . 0.0 112.127 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.4 t -59.47 -37.07 77.26 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.361 1.464 . . . . 0.0 112.414 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.5 mtmp? -84.74 -34.63 22.82 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 175.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.539 HD11 ' SG ' ' A' ' 32' ' ' CYS . 28.3 mt -60.84 -61.12 2.81 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.744 0.817 . . . . 0.0 109.766 177.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.1 p -149.19 164.76 33.84 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 122.98 1.371 . . . . 0.0 112.566 -177.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -78.03 -35.55 34.39 Favored Glycine 0 CA--C 1.526 0.751 0 O-C-N 119.561 -1.962 . . . . 0.0 111.99 175.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.7 t -46.4 -47.97 18.75 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 119.043 1.422 . . . . 0.0 112.877 -171.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -85.27 -37.84 19.56 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.667 1.187 . . . . 0.0 112.76 175.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.35 54.84 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.98 1.276 . . . . 0.0 114.216 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -81.78 12.29 4.11 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.766 1.626 . . . . 0.0 114.28 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.5 22.26 76.44 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.785 1.183 . . . . 0.0 114.49 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.96 -175.81 30.63 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.506 1.051 . . . . 0.0 112.626 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.13 149.65 29.73 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.227 1.011 . . . . 0.0 111.504 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.29 130.59 47.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 120.998 -1.064 . . . . 0.0 112.442 172.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -128.46 151.89 77.41 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.75 0.82 . . . . 0.0 111.435 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.03 153.63 67.47 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.506 2.137 . . . . 0.0 110.616 176.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.98 -20.46 62.44 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -73.93 -18.92 60.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.511 1.524 . . . . 0.0 113.399 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -86.72 129.57 34.82 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 120.512 -1.367 . . . . 0.0 109.834 174.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -79.64 125.37 29.53 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.94 170.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.36 174.15 3.96 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.4 1.08 . . . . 0.0 110.703 175.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -86.54 124.26 32.64 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.208 1.003 . . . . 0.0 110.451 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -124.33 139.03 54.29 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.097 1.498 . . . . 0.0 112.09 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.89 148.98 22.83 Favored 'General case' 0 C--O 1.22 -0.485 0 O-C-N 120.801 -1.187 . . . . 0.0 109.645 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -64.15 -40.05 95.32 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.399 -0.813 . . . . 0.0 112.369 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.79 -32.55 59.93 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.61 -36.73 28.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.612 -0.68 . . . . 0.0 112.72 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.2 m -54.38 -29.42 48.57 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.116 1.367 . . . . 0.0 112.26 175.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.14 86.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 117.963 -1.018 . . . . 0.0 112.94 174.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t -44.13 -58.04 3.07 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.791 2.037 . . . . 0.0 112.074 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -80.36 -56.2 4.36 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.878 172.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 42.57 -147.54 0.64 Allowed Glycine 0 C--N 1.35 1.326 0 C-N-CA 127.247 2.356 . . . . 0.0 112.353 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt 49.09 46.47 22.61 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 119.837 1.819 . . . . 0.0 114.277 174.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.77 23.0 62.91 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 121.266 -0.896 . . . . 0.0 114.201 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -132.24 159.47 38.96 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 126.379 1.872 . . . . 0.0 110.086 177.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -137.98 124.33 20.6 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 126.439 1.895 . . . . 0.0 109.835 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.53 125.94 28.24 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.517 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.1 m -120.08 137.79 53.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 120.055 1.298 . . . . 0.0 111.798 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.1 p -106.79 144.52 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 122.12 0.962 . . . . 0.0 110.395 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -111.37 177.72 4.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.82 1.248 . . . . 0.0 111.956 172.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.6 pp -104.87 27.53 8.01 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.598 1.559 . . . . 0.0 113.702 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 115.436 -2.221 . . . . 0.0 113.169 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -113.58 -38.95 4.18 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.884 0.74 . . . . 0.0 111.939 -171.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.2 m -47.86 -54.95 10.94 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.07 -1.019 . . . . 0.0 111.863 173.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 p -57.41 -34.09 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.065 1.346 . . . . 0.0 112.795 176.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 t -64.5 -29.48 70.52 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.33 1.452 . . . . 0.0 111.73 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.411 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 24.5 mmmt -94.37 -3.55 50.12 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 172.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 78.01 35.26 35.31 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-N 118.797 0.726 . . . . 0.0 113.073 -176.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.483 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 39.0 m-85 -99.19 166.3 11.3 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.949 1.3 . . . . 0.0 112.466 173.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 143.62 17.53 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.255 0.931 . . . . 0.0 111.308 179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.82 131.38 35.26 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.724 -0.868 . . . . 0.0 110.861 174.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -141.51 156.84 66.61 Favored Pre-proline 0 N--CA 1.471 0.589 0 C-N-CA 123.536 0.734 . . . . 0.0 111.144 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.69 139.28 62.61 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.731 2.287 . . . . 0.0 110.727 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -53.28 -18.84 2.68 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 175.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -71.31 -47.11 58.7 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.415 1.886 . . . . 0.0 111.902 170.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.69 -36.07 44.16 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.573 1.149 . . . . 0.0 111.993 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.7 t -88.17 112.03 46.86 Favored Pre-proline 0 C--O 1.246 0.869 0 C-N-CA 123.878 0.871 . . . . 0.0 111.668 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.91 153.96 64.79 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 123.033 2.489 . . . . 0.0 110.937 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -50.47 -35.07 27.34 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.026 -1.046 . . . . 0.0 113.798 175.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -71.1 -20.76 62.3 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.341 1.056 . . . . 0.0 113.378 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.85 -19.21 16.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.372 1.869 . . . . 0.0 114.656 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HD3' HG21 ' A' ' 30' ' ' VAL . 71.6 mtt180 -61.17 115.54 3.87 Favored 'General case' 0 CA--C 1.522 -0.104 0 O-C-N 121.25 -0.906 . . . . 0.0 109.982 173.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.638 HD11 ' HB3' ' A' ' 33' ' ' ASP . 11.9 mt -100.64 166.78 10.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.721 0.772 . . . . 0.0 110.846 178.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.32 27.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.811 1.244 . . . . 0.0 112.573 177.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.489 ' CE2' HD13 ' A' ' 22' ' ' LEU . 68.1 m-85 -65.46 -22.47 66.75 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.117 -0.989 . . . . 0.0 112.666 175.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.61 76.95 0.2 Allowed Glycine 0 CA--C 1.532 1.096 0 CA-C-N 120.025 1.284 . . . . 0.0 113.696 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -175.25 31.63 0.09 OUTLIER Glycine 0 N--CA 1.464 0.501 0 O-C-N 121.141 -1.211 . . . . 0.0 113.324 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.7 m -136.98 148.24 46.79 Favored 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 124.198 0.999 . . . . 0.0 111.272 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.9 m -58.65 -41.92 87.16 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.799 0.84 . . . . 0.0 112.053 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 p -109.55 -75.19 0.63 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.401 1.08 . . . . 0.0 109.069 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' A' ' 21' ' ' ARG . 13.8 p -147.18 149.11 15.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 126.337 1.855 . . . . 0.0 109.687 177.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.9 t -76.98 128.13 33.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.636 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -114.36 131.45 56.55 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.403 1.081 . . . . 0.0 111.25 177.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.638 ' HB3' HD11 ' A' ' 22' ' ' LEU . 1.5 p30 -84.58 97.7 9.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 124.186 1.946 . . . . 0.0 113.219 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.469 HD22 ' HB3' ' A' ' 41' ' ' LYS . 16.0 mt -54.67 -35.53 63.63 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.161 178.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.1 m -65.16 -29.37 70.2 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.6 mtpp -86.58 -37.93 17.65 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.476 1.034 . . . . 0.0 112.216 174.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.9 mp -64.81 -66.14 0.58 Allowed 'General case' 0 C--N 1.342 0.276 0 C-N-CA 123.913 0.885 . . . . 0.0 110.891 175.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 t -176.02 136.49 0.3 Allowed 'General case' 0 C--O 1.24 0.571 0 CA-C-O 122.09 0.948 . . . . 0.0 112.997 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.03 -27.91 39.28 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-O 118.082 -1.399 . . . . 0.0 113.215 175.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 35.0 t -50.03 -48.46 52.73 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 118.097 0.948 . . . . 0.0 110.162 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.469 ' HB3' HD22 ' A' ' 34' ' ' LEU . 54.1 mttt -82.72 -36.17 26.04 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.28 -41.88 87.72 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.961 0.791 . . . . 0.0 113.765 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -83.92 16.55 2.77 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.644 1.578 . . . . 0.0 114.069 174.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.19 42.19 76.92 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.465 1.031 . . . . 0.0 114.499 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -123.08 175.06 16.56 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.043 1.782 . . . . 0.0 113.925 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -150.66 149.03 29.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.993 1.317 . . . . 0.0 111.048 -175.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -65.84 123.0 18.6 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.119 -0.988 . . . . 0.0 111.483 173.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -127.34 148.22 65.36 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 124.636 1.175 . . . . 0.0 111.22 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -68.02 157.07 63.4 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.458 2.105 . . . . 0.0 111.125 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -62.07 -21.89 65.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -75.22 -13.07 60.41 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.255 2.222 . . . . 0.0 113.008 173.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.51 126.76 35.41 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 119.749 -1.845 . . . . 0.0 110.269 174.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -78.29 117.6 19.7 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.798 0.839 . . . . 0.0 110.076 171.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.2 t -163.06 176.87 9.64 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.333 1.453 . . . . 0.0 109.553 171.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -91.42 106.85 18.79 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 125.505 1.522 . . . . 0.0 110.147 172.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -101.3 141.94 33.44 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.037 0.922 . . . . 0.0 111.196 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.483 HD23 ' HG2' ' A' ' 60' ' ' GLU . 16.7 tp -89.98 134.84 34.0 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.071 -1.018 . . . . 0.0 109.526 170.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 pm0 -48.85 -44.93 40.08 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.079 1.352 . . . . 0.0 112.381 172.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.35 -23.64 64.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.715 1.206 . . . . 0.0 112.752 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.483 ' HG2' HD23 ' A' ' 57' ' ' LEU . 38.2 mm-40 -90.4 -39.02 12.92 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.947 1.299 . . . . 0.0 112.935 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.1 p -54.21 -28.5 41.29 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.936 -1.103 . . . . 0.0 112.603 173.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.78 -36.42 69.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.462 1.505 . . . . 0.0 113.157 175.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.3 m -70.63 -48.52 54.58 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.603 1.161 . . . . 0.0 113.281 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 17.3 m -62.29 -40.03 94.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.14 -176.35 25.63 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 122.616 1.12 . . . . 0.0 112.859 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -63.95 143.24 58.01 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.988 -1.301 . . . . 0.0 111.571 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.06 10.62 85.98 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 119.133 -0.815 . . . . 0.0 114.385 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -137.15 160.59 38.55 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.624 1.57 . . . . 0.0 110.694 177.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -137.83 117.32 12.91 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.312 1.845 . . . . 0.0 110.543 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.0 t -74.73 97.59 3.27 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.815 -0.553 . . . . 0.0 110.967 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -77.31 161.67 27.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.605 1.562 . . . . 0.0 110.821 173.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.7 t -123.67 134.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.035 1.334 . . . . 0.0 109.745 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -107.92 -63.52 1.31 Allowed 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.353 1.061 . . . . 0.0 112.065 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.0 mp -72.32 147.04 46.73 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 . . . . . 0 C--O 1.255 1.356 0 CA-C-O 116.196 -1.859 . . . . 0.0 114.411 177.926 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -116.9 -44.64 2.81 Favored 'General case' 0 C--O 1.22 -0.475 0 O-C-N 123.612 0.57 . . . . 0.0 109.728 -176.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.4 m -47.8 -55.92 8.58 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.658 -0.651 . . . . 0.0 111.284 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.5 p -58.91 -31.06 44.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.017 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.1 t -63.72 -30.12 71.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.727 0.811 . . . . 0.0 110.544 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.528 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 27.0 mmtt -96.18 -9.23 31.03 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.26 29.17 25.79 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 119.195 -0.78 . . . . 0.0 111.906 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.528 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 61.8 m-85 -89.75 168.74 11.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 118.331 1.065 . . . . 0.0 111.715 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.66 126.66 6.92 Favored Glycine 0 CA--C 1.519 0.306 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.546 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.0 m -75.78 139.43 41.8 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.95 -0.735 . . . . 0.0 111.076 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.5 mt -154.99 155.0 29.78 Favored Pre-proline 0 C--O 1.206 -1.202 0 O-C-N 124.19 0.931 . . . . 0.0 112.051 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.532 ' HA ' HG21 ' A' ' 29' ' ' THR . 51.0 Cg_endo -68.06 133.95 30.4 Favored 'Trans proline' 0 CA--C 1.506 -0.916 0 C-N-CA 123.98 3.12 . . . . 0.0 111.116 179.402 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.406 ' HG3' ' CG1' ' A' ' 30' ' ' VAL . 63.2 mt-30 -47.34 -27.83 1.77 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 123.191 0.596 . . . . 0.0 111.397 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.6 p -59.73 -47.43 85.7 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -83.12 -30.89 27.55 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.338 0.59 . . . . 0.0 112.46 177.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 20' ' ' ALA . 17.7 t -93.19 126.63 50.1 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 121.71 -0.619 . . . . 0.0 111.694 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.512 ' HG2' ' HB2' ' A' ' 20' ' ' ALA . 50.0 Cg_endo -67.49 153.01 77.81 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.855 2.37 . . . . 0.0 112.265 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -52.91 -35.08 57.72 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -73.23 -16.34 61.41 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 123.927 0.891 . . . . 0.0 111.13 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.512 ' HB2' ' HG2' ' A' ' 17' ' ' PRO . . . -95.29 -30.26 14.05 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 124.072 0.858 . . . . 0.0 113.052 177.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -54.27 113.01 1.1 Allowed 'General case' 0 C--N 1.334 -0.069 0 O-C-N 121.584 -0.698 . . . . 0.0 110.07 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.551 HD13 ' CE2' ' A' ' 24' ' ' TYR . 13.0 mt -96.33 177.92 5.54 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.776 0.798 . . . . 0.0 110.2 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.8 p -122.38 34.58 5.11 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.385 0.674 . . . . 0.0 111.391 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.551 ' CE2' HD13 ' A' ' 22' ' ' LEU . 59.1 m-85 -73.82 -16.87 61.13 Favored 'General case' 0 C--O 1.203 -1.379 0 O-C-N 122.092 -0.38 . . . . 0.0 110.84 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.6 80.99 0.07 OUTLIER Glycine 0 C--O 1.219 -0.839 0 CA-C-O 122.439 1.021 . . . . 0.0 111.905 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.2 26.07 0.04 OUTLIER Glycine 0 C--O 1.223 -0.538 0 O-C-N 120.796 -1.414 . . . . 0.0 112.795 -179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 56.2 m -124.44 156.98 36.27 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 117.02 0.41 . . . . 0.0 111.533 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -48.9 -44.73 40.43 Favored 'General case' 0 C--O 1.223 -0.338 0 O-C-N 123.923 0.765 . . . . 0.0 111.122 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.572 HG23 ' H ' ' A' ' 30' ' ' VAL . 1.2 t -132.34 -60.3 0.9 Allowed 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.601 0.76 . . . . 0.0 110.965 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.572 ' H ' HG23 ' A' ' 29' ' ' THR . 13.9 p -145.35 140.29 22.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 CA-C-O 121.847 0.832 . . . . 0.0 110.988 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 1.3 t -82.63 140.57 33.1 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.291 -0.88 . . . . 0.0 111.969 176.09 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -116.19 130.07 56.61 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.835 1.302 . . . . 0.0 110.742 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.528 ' O ' HD23 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -76.16 106.39 7.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 123.128 1.442 . . . . 0.0 112.146 177.599 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mt -64.94 -37.7 88.53 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 119.271 -2.143 . . . . 0.0 110.182 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 m -53.18 -32.8 49.72 Favored 'General case' 0 CA--C 1.528 0.123 0 O-C-N 121.803 -0.56 . . . . 0.0 112.05 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.1 mttt -90.65 -32.48 16.2 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 33' ' ' ASP . 3.9 mm? -77.32 -70.46 0.47 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 123.288 0.635 . . . . 0.0 109.745 -178.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.502 HG21 ' HB2' ' A' ' 63' ' ' SER . 9.8 t -140.21 145.9 37.99 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 123.242 1.496 . . . . 0.0 112.145 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -84.56 33.44 3.24 Favored Glycine 0 N--CA 1.451 -0.348 0 O-C-N 119.685 -1.884 . . . . 0.0 112.69 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.3 t -56.84 -39.4 74.19 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 118.138 0.969 . . . . 0.0 110.717 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -80.86 -29.8 35.73 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 121.516 0.674 . . . . 0.0 112.108 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -69.42 -36.19 77.3 Favored Glycine 0 C--N 1.336 0.544 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.0 mttt -78.61 12.67 1.94 Allowed 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.58 42.08 14.63 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.788 -0.525 . . . . 0.0 111.788 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -115.65 169.39 12.91 Favored Glycine 0 CA--C 1.518 0.244 0 CA-C-N 117.033 0.417 . . . . 0.0 112.774 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -149.74 155.91 40.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.833 0.825 . . . . 0.0 112.127 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 t -73.71 130.8 40.73 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.102 -0.999 . . . . 0.0 112.456 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -135.76 148.44 65.35 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 121.598 0.713 . . . . 0.0 112.063 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.18 159.22 54.08 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.506 2.138 . . . . 0.0 111.508 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.464 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 14.4 mt -60.96 -15.84 35.92 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.55 -10.63 57.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.058 0.543 . . . . 0.0 111.455 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.46 129.15 41.34 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 121.775 0.798 . . . . 0.0 109.877 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -80.45 120.51 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.715 176.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -172.83 170.53 4.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.456 0.646 . . . . 0.0 111.169 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 tttt -83.08 111.13 18.6 Favored 'General case' 0 CA--C 1.522 -0.121 0 O-C-N 121.859 -0.525 . . . . 0.0 110.456 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -117.87 128.96 55.34 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.746 0.784 . . . . 0.0 111.293 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.607 HD12 ' HG3' ' A' ' 60' ' ' GLU . 15.7 mt -84.82 156.39 21.35 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.589 -0.694 . . . . 0.0 110.636 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -69.61 -33.95 73.39 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.351 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.47 -31.05 33.17 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 120.82 0.343 . . . . 0.0 111.813 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.607 ' HG3' HD12 ' A' ' 57' ' ' LEU . 8.7 mm-40 -80.45 -30.98 37.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.983 0.42 . . . . 0.0 111.007 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.406 ' HB2' ' HD3' ' A' ' 69' ' ' LYS . 93.6 p -55.31 -37.87 67.93 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.628 -0.67 . . . . 0.0 111.588 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.96 -36.69 72.92 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 123.525 0.516 . . . . 0.0 112.074 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.502 ' HB2' HG21 ' A' ' 38' ' ' THR . 47.0 t -54.42 -54.37 41.69 Favored 'General case' 0 C--N 1.334 -0.108 0 O-C-N 123.411 0.444 . . . . 0.0 111.474 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 8.8 m -57.06 -49.97 74.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.377 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 116.21 175.6 17.92 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-O 122.496 1.053 . . . . 0.0 112.067 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -61.4 129.24 40.25 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.329 -1.101 . . . . 0.0 110.436 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.36 6.58 70.79 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 113.483 -179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -141.93 162.5 35.31 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.395 0.617 . . . . 0.0 110.951 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.464 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 64.5 mmtt -138.49 138.75 38.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 122.133 0.968 . . . . 0.0 111.93 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -84.49 106.04 15.76 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.583 -0.698 . . . . 0.0 110.672 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.33 156.17 21.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.674 0.75 . . . . 0.0 111.795 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.12 144.65 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 C-N-CA 123.226 0.61 . . . . 0.0 111.18 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -118.72 -179.9 3.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.541 0.686 . . . . 0.0 111.853 176.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.464 ' C ' HD12 ' A' ' 74' ' ' LEU . 4.0 pp -124.73 171.45 10.09 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.377 0.671 . . . . 0.0 111.878 178.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.3 t60 . . . . . 0 C--O 1.248 0.987 0 CA-C-O 116.966 -1.492 . . . . 0.0 111.935 176.816 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 . . . . . 0 N--CA 1.479 1.016 0 CA-C-O 118.197 -0.906 . . . . 0.0 109.157 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -116.48 -28.92 6.31 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 123.644 0.59 . . . . 0.0 111.004 -173.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.2 m -53.67 -48.24 69.65 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.513 -1.367 . . . . 0.0 111.829 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -56.43 -27.1 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.552 1.141 . . . . 0.0 113.187 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 t -66.8 -35.19 79.49 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.875 1.27 . . . . 0.0 111.287 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.455 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 3.6 mmmm -96.9 -7.65 32.79 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 174.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.25 44.35 7.05 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.203 0.906 . . . . 0.0 112.396 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.455 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 35.6 m-85 -108.65 163.31 13.36 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.091 1.356 . . . . 0.0 112.169 176.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.77 145.29 18.4 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.276 0.941 . . . . 0.0 111.382 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.5 m -83.13 136.3 34.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.7 -0.883 . . . . 0.0 112.025 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.1 mt -148.6 155.83 41.8 Favored Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.738 0.815 . . . . 0.0 111.857 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.53 142.69 79.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.431 2.087 . . . . 0.0 110.884 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -52.54 -21.18 3.54 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 175.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 t -74.17 -46.96 38.92 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.102 1.761 . . . . 0.0 112.868 170.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -68.37 -50.27 54.28 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.276 1.03 . . . . 0.0 110.775 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.53 118.21 70.55 Favored Pre-proline 0 C--O 1.246 0.88 0 O-C-N 121.566 -0.709 . . . . 0.0 111.535 -174.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.02 151.06 86.67 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.793 2.329 . . . . 0.0 110.847 -177.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -52.33 -24.32 7.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -79.55 -28.73 41.21 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.367 1.467 . . . . 0.0 113.989 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -24.47 22.4 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.562 1.145 . . . . 0.0 111.206 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HG2' HG21 ' A' ' 30' ' ' VAL . 97.0 mtt180 -48.32 117.99 2.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.412 0.685 . . . . 0.0 110.885 174.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.436 HD21 ' HB2' ' A' ' 33' ' ' ASP . 19.5 mt -99.77 172.08 7.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.923 0.868 . . . . 0.0 110.455 179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.6 p -100.65 11.29 39.83 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.848 1.659 . . . . 0.0 112.985 177.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.418 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 54.4 m-85 -77.44 -11.74 59.88 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.133 -0.98 . . . . 0.0 112.2 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.72 -106.23 0.57 Allowed Glycine 0 C--O 1.216 -1.0 0 CA-C-O 116.771 -2.127 . . . . 0.0 110.176 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 39.48 28.04 0.1 Allowed Glycine 0 N--CA 1.474 1.21 0 C-N-CA 127.342 2.401 . . . . 0.0 115.419 175.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.0 m -145.67 146.71 31.4 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.441 1.496 . . . . 0.0 108.972 -169.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 m -68.66 -22.71 64.38 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 p -127.0 -75.86 0.58 Allowed 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 125.943 1.697 . . . . 0.0 110.659 -175.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.454 HG21 ' HG2' ' A' ' 21' ' ' ARG . 7.1 p -148.58 150.44 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 O-C-N 121.312 -0.868 . . . . 0.0 110.863 174.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 t -78.77 129.44 34.64 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 121.516 -0.74 . . . . 0.0 110.354 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.407 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.7 OUTLIER -111.83 140.21 46.67 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.245 1.022 . . . . 0.0 112.964 177.527 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.436 ' HB2' HD21 ' A' ' 22' ' ' LEU . 14.4 t0 -88.98 104.31 16.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.262 1.029 . . . . 0.0 110.987 -178.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.508 HD22 ' HB3' ' A' ' 41' ' ' LYS . 53.7 mt -58.37 -33.11 69.21 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.022 175.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 t -68.24 -31.13 70.4 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.122 1.369 . . . . 0.0 111.868 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt -84.99 -38.78 18.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.808 1.243 . . . . 0.0 111.89 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.407 HD11 ' SG ' ' A' ' 32' ' ' CYS . 43.0 mt -61.06 -60.21 4.14 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.089 0.955 . . . . 0.0 111.011 176.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.2 t -171.39 155.64 4.28 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 122.16 0.981 . . . . 0.0 113.564 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.89 -29.06 71.34 Favored Glycine 0 CA--C 1.534 1.275 0 O-C-N 120.28 -1.513 . . . . 0.0 113.786 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.5 t -52.09 -47.37 65.27 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.395 1.597 . . . . 0.0 110.233 -174.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.508 ' HB3' HD22 ' A' ' 34' ' ' LEU . 39.0 mmtt -86.3 -38.27 17.69 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.606 1.162 . . . . 0.0 113.194 175.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.99 -42.85 54.94 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 124.157 0.884 . . . . 0.0 113.601 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.568 ' HE3' ' OE1' ' A' ' 60' ' ' GLU . 7.6 mtmp? -78.99 15.44 1.11 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.033 1.733 . . . . 0.0 113.928 173.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.11 32.67 83.21 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.251 1.881 . . . . 0.0 114.42 -176.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -97.14 170.99 26.52 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-O 122.779 1.211 . . . . 0.0 113.417 177.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.2 tt0 -138.93 150.07 45.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.148 1.379 . . . . 0.0 111.756 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 90.5 m -71.87 120.25 17.2 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 120.754 -1.216 . . . . 0.0 111.192 173.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -110.52 150.69 42.02 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.307 1.043 . . . . 0.0 110.661 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.04 152.45 76.63 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.635 2.224 . . . . 0.0 111.543 176.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.663 HD11 ' HA2' ' A' ' 67' ' ' GLY . 39.6 mt -57.59 -24.52 56.77 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -73.76 -19.58 60.74 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.163 1.785 . . . . 0.0 112.862 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -89.18 134.82 33.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 123.08 1.419 . . . . 0.0 110.744 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -96.54 120.73 37.38 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 125.069 1.348 . . . . 0.0 109.439 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.6 p -166.76 170.67 12.19 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.174 1.39 . . . . 0.0 109.953 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -73.62 108.01 6.21 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.624 1.17 . . . . 0.0 109.863 175.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.91 145.58 42.05 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.075 0.95 . . . . 0.0 109.783 174.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.02 139.75 32.56 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.176 0.59 . . . . 0.0 110.326 173.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -63.14 -42.08 99.4 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.599 -0.688 . . . . 0.0 112.525 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.05 76.98 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.592 -0.692 . . . . 0.0 111.991 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.568 ' OE1' ' HE3' ' A' ' 43' ' ' LYS . 3.8 tp10 -85.7 -33.79 21.43 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.395 1.078 . . . . 0.0 113.482 -177.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.7 p -53.11 -34.2 55.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.693 1.597 . . . . 0.0 112.377 173.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.61 -36.18 71.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.38 1.072 . . . . 0.0 111.844 176.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -48.25 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.327 1.051 . . . . 0.0 112.473 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 67.6 m -60.84 -41.97 96.85 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 122.448 0.299 . . . . 0.0 111.693 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 113.37 174.24 18.89 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 122.679 1.155 . . . . 0.0 112.732 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -64.53 129.12 38.65 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.707 0.803 . . . . 0.0 109.76 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.663 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 88.36 13.99 62.69 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-O 117.871 -1.516 . . . . 0.0 113.42 -177.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -139.57 156.36 46.93 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.663 1.585 . . . . 0.0 110.639 176.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -127.04 119.0 25.55 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.253 1.821 . . . . 0.0 110.118 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.2 t -76.04 104.95 6.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.415 -0.803 . . . . 0.0 111.408 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 60.9 m -101.23 161.19 13.79 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.712 0.768 . . . . 0.0 112.058 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.8 m -116.22 145.07 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.604 0.762 . . . . 0.0 110.993 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -104.88 -80.06 0.55 Allowed 'General case' 0 N--CA 1.461 0.094 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.402 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.6 mp 37.74 52.45 1.41 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.151 1.78 . . . . 0.0 113.055 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.3 t60 . . . . . 0 C--O 1.248 1.008 0 C-N-CA 125.911 1.684 . . . . 0.0 110.093 -177.071 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 120.598 0.237 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -111.66 -20.75 12.01 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.302 -167.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 97.0 m -51.49 -63.18 1.22 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.275 1.03 . . . . 0.0 111.421 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.6 p -56.59 -34.81 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 112.773 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.5 t -62.64 -26.05 68.43 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.949 1.3 . . . . 0.0 112.422 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HE2' ' HA ' ' A' ' 6' ' ' LYS . 2.6 mmpt? -99.25 -7.18 26.79 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 171.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.38 28.74 35.33 Favored Glycine 0 CA--C 1.535 1.315 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.377 -175.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -90.54 160.84 15.76 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.672 1.736 . . . . 0.0 113.649 175.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.42 123.83 7.7 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 125.771 1.653 . . . . 0.0 111.797 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -73.85 131.11 41.16 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 121.333 -1.098 . . . . 0.0 111.283 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 70.6 mt -142.19 164.19 35.11 Favored Pre-proline 0 N--CA 1.472 0.649 0 C-N-CA 123.021 0.528 . . . . 0.0 110.583 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.42 141.49 35.19 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.161 1.907 . . . . 0.0 111.656 171.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -51.02 -15.57 0.33 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.864 1.666 . . . . 0.0 115.181 173.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 t -78.27 -39.54 39.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.953 2.101 . . . . 0.0 113.021 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -86.25 -37.1 18.95 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.69 1.596 . . . . 0.0 110.924 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.3 t -92.49 116.33 66.31 Favored Pre-proline 0 C--O 1.245 0.856 0 C-N-CA 124.431 1.092 . . . . 0.0 111.921 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.76 151.22 86.49 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.541 2.161 . . . . 0.0 111.672 -175.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -53.8 -28.71 36.75 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -72.89 -19.7 61.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.697 1.199 . . . . 0.0 113.658 176.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -102.65 -16.08 16.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 128.048 2.539 . . . . 0.0 114.276 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.519 ' HG2' HG21 ' A' ' 30' ' ' VAL . 89.5 mtt180 -59.74 105.25 0.36 Allowed 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.254 -0.903 . . . . 0.0 112.2 171.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.617 HD11 ' HB3' ' A' ' 33' ' ' ASP . 10.7 mt -93.6 163.32 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 111.846 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 p -103.71 22.39 14.5 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.11 1.764 . . . . 0.0 114.407 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.551 ' CE2' HD13 ' A' ' 22' ' ' LEU . 85.2 m-85 -67.79 3.51 1.44 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.964 1.706 . . . . 0.0 115.452 175.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 38.98 64.33 0.93 Allowed Glycine 0 N--CA 1.475 1.261 0 C-N-CA 126.917 2.199 . . . . 0.0 114.876 171.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -165.22 28.17 0.2 Allowed Glycine 0 C--O 1.226 -0.395 0 CA-C-O 118.738 -1.035 . . . . 0.0 113.472 -173.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.6 m -130.42 161.91 30.31 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.6 0.76 . . . . 0.0 112.422 177.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -53.54 -36.34 61.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.508 1.123 . . . . 0.0 113.549 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.29 -50.29 0.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.543 1.137 . . . . 0.0 111.074 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.519 HG21 ' HG2' ' A' ' 21' ' ' ARG . 11.9 p -147.24 149.29 15.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 122.07 0.938 . . . . 0.0 111.432 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.412 ' HB3' ' HB2' ' A' ' 22' ' ' LEU . 4.2 t -89.7 137.66 32.14 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 124.355 1.062 . . . . 0.0 108.8 172.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.16 133.18 56.27 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.105 0.962 . . . . 0.0 111.225 177.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.617 ' HB3' HD11 ' A' ' 22' ' ' LEU . 2.7 p30 -82.36 90.01 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 123.97 1.843 . . . . 0.0 112.679 -177.333 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -50.31 -33.66 20.91 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.123 1.156 . . . . 0.0 114.123 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -79.33 -11.51 59.93 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.81 -37.28 8.35 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.213 1.405 . . . . 0.0 109.911 178.265 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.29 -53.32 37.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.651 1.58 . . . . 0.0 111.753 171.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 82.6 p -141.69 179.33 6.9 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.17 0.988 . . . . 0.0 111.342 -175.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -94.02 -54.34 1.64 Allowed Glycine 0 CA--C 1.526 0.76 0 O-C-N 120.055 -1.653 . . . . 0.0 111.325 172.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.6 t -44.89 -61.82 1.46 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.861 1.664 . . . . 0.0 110.858 -172.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.455 ' HE2' ' OE2' ' A' ' 46' ' ' GLU . 34.1 mmtp -56.35 -46.31 80.02 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.371 1.468 . . . . 0.0 112.935 176.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.91 -29.77 62.4 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.116 0.865 . . . . 0.0 115.011 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -87.51 8.22 25.92 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.14 32.78 30.93 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.341 0.972 . . . . 0.0 113.422 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.8 164.03 28.65 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 124.282 0.944 . . . . 0.0 113.332 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.455 ' OE2' ' HE2' ' A' ' 41' ' ' LYS . 8.6 tp10 -152.13 151.8 31.51 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.574 1.15 . . . . 0.0 112.539 178.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 36.4 m -70.19 121.46 17.6 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.874 -1.141 . . . . 0.0 111.369 174.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -121.89 148.25 50.72 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.977 0.911 . . . . 0.0 111.784 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -69.29 155.44 67.48 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.456 2.104 . . . . 0.0 110.697 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.7 mt -60.59 -21.31 62.49 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -74.17 -20.53 60.18 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 128.258 2.623 . . . . 0.0 112.86 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -88.62 119.89 29.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.298 -1.501 . . . . 0.0 110.638 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -63.04 117.67 6.78 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.136 0.574 . . . . 0.0 111.09 168.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.9 t -155.66 -173.1 4.39 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.305 1.042 . . . . 0.0 110.055 166.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -96.84 108.1 20.71 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.201 1.8 . . . . 0.0 110.098 167.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -107.87 147.67 30.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.66 120.36 42.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.402 1.481 . . . . 0.0 110.255 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.406 ' H ' ' NE2' ' A' ' 58' ' ' GLN . 5.7 mp0 -55.36 -34.79 64.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.609 0.764 . . . . 0.0 111.685 -176.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.77 -39.4 65.35 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.693 2.397 . . . . 0.0 113.956 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -105.85 -13.73 15.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.143 1.377 . . . . 0.0 112.386 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -55.83 -37.57 68.87 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.14 -1.6 . . . . 0.0 112.108 174.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.83 -32.0 71.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.54 1.536 . . . . 0.0 113.417 173.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -63.94 -48.96 74.48 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.268 1.427 . . . . 0.0 111.971 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.9 t -67.98 -29.93 69.08 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 175.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.73 176.62 25.89 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-O 122.865 1.258 . . . . 0.0 113.672 176.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -64.68 130.76 44.79 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.841 -1.388 . . . . 0.0 111.822 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.54 4.79 60.56 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.108 0.861 . . . . 0.0 114.054 -178.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -132.82 161.23 34.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.695 1.598 . . . . 0.0 110.594 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -138.17 120.18 15.51 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.046 1.738 . . . . 0.0 110.788 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.2 t -73.25 92.17 1.75 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 122.778 0.431 . . . . 0.0 110.579 177.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.4 t -80.35 160.22 25.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.936 1.694 . . . . 0.0 110.667 177.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.8 p -133.53 143.12 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.134 0.973 . . . . 0.0 111.0 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 36.1 m95 -109.69 179.22 4.19 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.32 1.048 . . . . 0.0 110.335 177.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -59.07 148.53 30.71 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.404 -0.81 . . . . 0.0 111.544 166.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.5 p80 . . . . . 0 C--O 1.248 0.976 0 CA-C-O 115.981 -1.961 . . . . 0.0 112.978 169.808 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 118.469 -0.777 . . . . 0.0 109.142 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -108.03 -26.49 10.64 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.3 0.571 . . . . 0.0 111.256 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.599 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 73.9 m -51.32 -59.26 4.41 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 120.814 -1.179 . . . . 0.0 111.099 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.79 -32.76 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -63.11 -31.83 73.07 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.602 1.161 . . . . 0.0 110.994 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -95.09 -11.49 28.17 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.74 -1.124 . . . . 0.0 113.569 174.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.19 33.91 22.04 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 124.157 0.911 . . . . 0.0 112.397 -177.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -80.35 169.17 18.09 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 118.74 1.27 . . . . 0.0 112.342 175.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.851 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -114.84 117.58 4.08 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 123.648 0.642 . . . . 0.0 111.544 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.0 m -72.16 131.92 43.45 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.259 175.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 79.8 mt -147.87 156.39 44.32 Favored Pre-proline 0 C--O 1.218 -0.597 0 O-C-N 124.309 1.006 . . . . 0.0 111.224 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.469 ' HA ' HG21 ' A' ' 29' ' ' THR . 56.1 Cg_endo -66.3 139.66 55.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.089 2.526 . . . . 0.0 111.247 175.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -52.22 -20.68 2.78 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.1 t -66.74 -48.13 70.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.948 1.299 . . . . 0.0 112.611 170.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.44 -38.1 42.06 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.157 0.983 . . . . 0.0 111.361 177.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -87.61 125.86 63.81 Favored Pre-proline 0 CA--C 1.541 0.623 0 O-C-N 120.866 -1.146 . . . . 0.0 111.918 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -63.25 146.36 93.81 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.997 2.465 . . . . 0.0 110.691 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -52.2 -20.38 2.58 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.32 -35.76 30.58 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.867 1.667 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.44 ' HB1' ' OD1' ' A' ' 33' ' ' ASP . . . -83.01 -26.47 31.2 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 176.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -44.84 110.65 0.24 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.243 1.017 . . . . 0.0 111.429 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 33' ' ' ASP . 9.8 mt -95.72 175.15 6.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.475 1.131 . . . . 0.0 110.221 -178.277 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.1 p -127.13 29.23 5.63 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.361 1.064 . . . . 0.0 112.429 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.599 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 9.5 m-85 -71.5 -15.94 62.33 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 121.409 -0.807 . . . . 0.0 111.207 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.14 82.8 0.07 OUTLIER Glycine 0 CA--C 1.53 0.978 0 CA-C-O 124.395 2.108 . . . . 0.0 112.095 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 174.25 32.71 0.03 OUTLIER Glycine 0 C--O 1.227 -0.327 0 O-C-N 120.627 -1.514 . . . . 0.0 113.339 -176.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 19.3 m -131.45 165.98 22.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 122.408 0.283 . . . . 0.0 111.742 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.7 p -54.0 -46.61 71.81 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 124.666 1.229 . . . . 0.0 112.251 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.469 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.4 t -132.15 -54.84 0.98 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.577 1.151 . . . . 0.0 111.424 -178.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 p -149.82 140.77 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 122.296 1.046 . . . . 0.0 110.605 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 76.6 m -83.2 138.93 33.42 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.904 -1.123 . . . . 0.0 109.98 171.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.755 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -117.1 140.98 48.84 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 122.855 1.312 . . . . 0.0 111.056 173.834 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.44 ' OD1' ' HB1' ' A' ' 20' ' ' ALA . 1.2 p30 -76.29 106.84 8.14 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 124.123 1.916 . . . . 0.0 112.889 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.851 HD21 ' HA3' ' A' ' 9' ' ' GLY . 12.5 mt -67.06 -36.19 81.49 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 119.284 -2.135 . . . . 0.0 110.908 -178.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.5 p -67.79 -22.75 65.17 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -35.06 11.01 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 124.054 0.942 . . . . 0.0 110.652 -179.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.755 HD11 ' SG ' ' A' ' 32' ' ' CYS . 48.3 mt -66.33 -62.23 1.58 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.928 0.891 . . . . 0.0 111.027 176.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -154.38 141.09 19.02 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.339 0.59 . . . . 0.0 112.379 -178.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.41 -28.78 67.82 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-O 118.432 -1.204 . . . . 0.0 113.265 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 34.8 t -47.02 -57.91 4.54 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 125.026 1.33 . . . . 0.0 109.618 -176.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -83.57 -29.93 27.42 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.297 0.639 . . . . 0.0 112.654 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.08 -38.32 65.92 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.604 0.621 . . . . 0.0 113.935 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -89.62 16.1 8.4 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.494 1.518 . . . . 0.0 112.882 176.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.69 34.37 87.22 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.147 0.403 . . . . 0.0 112.732 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.94 174.96 32.24 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-O 122.569 1.094 . . . . 0.0 112.111 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.93 136.27 28.41 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 122.424 1.107 . . . . 0.0 112.136 -177.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.5 t -73.53 123.45 23.96 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.899 -1.126 . . . . 0.0 112.488 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -127.28 147.09 60.56 Favored Pre-proline 0 CA--C 1.538 0.501 0 O-C-N 120.639 -1.288 . . . . 0.0 111.088 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -67.25 153.93 75.72 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.33 2.02 . . . . 0.0 110.565 176.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.568 HD11 ' HA2' ' A' ' 67' ' ' GLY . 13.7 mt -61.18 -18.46 58.31 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.0 -14.99 57.43 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.72 1.208 . . . . 0.0 112.258 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -88.93 139.8 30.09 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.705 -1.247 . . . . 0.0 110.009 175.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -96.7 122.33 39.52 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.841 0.856 . . . . 0.0 110.808 174.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.4 p -167.67 169.81 11.52 Favored 'General case' 0 C--O 1.214 -0.813 0 C-N-CA 123.224 0.61 . . . . 0.0 110.575 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -74.06 111.19 8.98 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.937 -0.477 . . . . 0.0 110.575 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.36 136.07 53.8 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.97 1.308 . . . . 0.0 111.369 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -84.09 143.6 29.59 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 120.885 -1.134 . . . . 0.0 110.734 176.658 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.03 -41.87 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.736 0.814 . . . . 0.0 113.089 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.73 -36.15 67.7 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.74 -0.6 . . . . 0.0 111.432 176.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.72 -30.9 51.95 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 121.853 -0.529 . . . . 0.0 111.242 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.416 ' HB2' ' CE ' ' A' ' 69' ' ' LYS . 28.3 p -55.27 -31.34 61.5 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 124.552 1.141 . . . . 0.0 111.722 178.309 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.93 -34.76 65.92 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 118.058 -0.973 . . . . 0.0 112.813 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.4 t -46.53 -53.08 12.03 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.362 1.465 . . . . 0.0 111.886 177.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 2.2 m -87.21 -56.54 3.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.401 174.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 39.48 -147.03 0.19 Allowed Glycine 0 C--O 1.217 -0.947 0 C-N-CA 125.599 1.571 . . . . 0.0 112.094 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 77.8 mttt 47.42 46.37 17.25 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.052 1.426 . . . . 0.0 113.909 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.568 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 81.63 19.8 65.21 Favored Glycine 0 CA--C 1.534 1.245 0 N-CA-C 114.241 0.456 . . . . 0.0 114.241 -174.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -139.23 150.98 46.16 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.941 1.696 . . . . 0.0 110.23 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -121.2 157.89 29.25 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.402 1.081 . . . . 0.0 109.954 178.046 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 50.6 t -101.5 96.28 7.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.652 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 33.8 m -89.67 144.22 26.17 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.16 0.584 . . . . 0.0 111.455 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.7 p -114.44 142.47 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.099 0.96 . . . . 0.0 110.186 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -108.18 -62.71 1.41 Allowed 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 123.627 0.771 . . . . 0.0 112.601 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -110.67 161.12 16.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.469 1.108 . . . . 0.0 110.513 179.119 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 115.384 -2.246 . . . . 0.0 113.334 170.954 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 118.606 -0.711 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -119.97 -27.06 5.44 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.736 0.647 . . . . 0.0 111.096 -175.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -48.8 -59.28 3.69 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.517 -0.739 . . . . 0.0 111.168 176.197 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.56 -29.01 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.8 t -70.29 -30.03 66.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.442 1.097 . . . . 0.0 111.714 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.2 mmtt -94.4 -10.12 33.52 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 175.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.58 30.69 10.28 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-O 118.486 -1.175 . . . . 0.0 113.172 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -91.29 169.58 10.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.814 1.307 . . . . 0.0 112.062 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -122.33 133.92 9.49 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.102 0.858 . . . . 0.0 111.507 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 68.1 m -81.23 134.85 35.68 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 121.911 -0.758 . . . . 0.0 111.487 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.44 ' O ' HG12 ' A' ' 30' ' ' VAL . 38.6 mt -145.76 155.78 52.24 Favored Pre-proline 0 C--O 1.22 -0.463 0 O-C-N 124.066 0.854 . . . . 0.0 111.87 178.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.08 141.8 71.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 123.222 2.615 . . . . 0.0 110.852 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.424 ' HA ' HG11 ' A' ' 30' ' ' VAL . 87.4 mt-30 -54.11 -22.18 10.38 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.059 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.7 p -69.23 -46.17 68.01 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 125.409 1.483 . . . . 0.0 113.004 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.54 -37.42 56.7 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.991 0.916 . . . . 0.0 111.96 176.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.6 t -89.33 118.75 69.4 Favored Pre-proline 0 C--O 1.243 0.724 0 O-C-N 121.433 -0.792 . . . . 0.0 111.832 -178.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -63.23 150.58 88.2 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.711 2.274 . . . . 0.0 110.833 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -54.27 -20.49 7.18 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -82.81 -24.52 33.31 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.884 1.273 . . . . 0.0 113.815 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -97.26 -19.91 18.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.848 1.659 . . . . 0.0 112.059 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -53.78 118.85 4.28 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 121.063 -1.023 . . . . 0.0 110.558 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.479 HD12 ' HB3' ' A' ' 31' ' ' CYS . 5.3 mt -103.0 173.85 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.315 1.055 . . . . 0.0 110.519 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.1 p -127.15 28.5 5.74 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 0.0 112.176 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -69.63 -18.15 63.57 Favored 'General case' 0 C--O 1.207 -1.156 0 O-C-N 121.481 -0.762 . . . . 0.0 110.988 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.88 87.32 0.08 OUTLIER Glycine 0 CA--C 1.526 0.726 0 CA-C-O 124.174 1.986 . . . . 0.0 112.032 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.68 31.15 0.03 OUTLIER Glycine 0 C--O 1.221 -0.718 0 O-C-N 120.346 -1.679 . . . . 0.0 113.694 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.406 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 93.3 m -138.83 145.39 40.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.219 0.509 . . . . 0.0 110.488 176.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.3 t -60.81 -40.78 93.97 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 124.156 0.91 . . . . 0.0 111.447 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.7 p -108.65 -73.62 0.68 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.727 1.211 . . . . 0.0 111.066 -177.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 11' ' ' LEU . 7.9 p -150.76 148.36 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.864 1.266 . . . . 0.0 110.74 175.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.479 ' HB3' HD12 ' A' ' 22' ' ' LEU . 2.0 m -76.72 136.56 39.07 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 120.948 -1.095 . . . . 0.0 109.964 171.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.438 ' SG ' HD21 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -120.45 133.2 55.45 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 125.067 1.347 . . . . 0.0 112.114 175.665 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.569 ' OD2' ' HE2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -77.29 100.19 5.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 122.915 1.341 . . . . 0.0 113.46 178.547 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mt -59.35 -35.3 73.6 Favored 'General case' 0 C--O 1.22 -0.477 0 O-C-N 120.606 -1.309 . . . . 0.0 111.439 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.2 t -56.63 -39.7 74.12 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.933 0.893 . . . . 0.0 112.622 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.569 ' HE2' ' OD2' ' A' ' 33' ' ' ASP . 27.2 mtmt -83.42 -35.33 25.11 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 123.288 0.635 . . . . 0.0 112.634 176.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.438 HD21 ' SG ' ' A' ' 32' ' ' CYS . 8.9 mp -63.7 -59.58 4.4 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.283 1.033 . . . . 0.0 110.22 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -167.84 143.65 3.93 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 122.469 1.128 . . . . 0.0 113.171 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -72.37 -12.54 76.84 Favored Glycine 0 CA--C 1.525 0.715 0 CA-C-O 117.218 -1.879 . . . . 0.0 113.629 175.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.405 ' HB2' ' CB ' ' A' ' 63' ' ' SER . 17.0 t -44.71 -48.55 10.71 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 120.715 2.257 . . . . 0.0 113.428 -175.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -83.42 -42.38 17.03 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.5 172.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -52.28 -30.11 31.58 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-N 118.809 0.731 . . . . 0.0 114.227 178.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -78.46 10.75 2.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.051 1.74 . . . . 0.0 113.45 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.31 35.12 77.09 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.503 1.049 . . . . 0.0 112.624 -175.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -104.64 -176.61 24.92 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-O 122.554 1.085 . . . . 0.0 113.309 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -146.62 150.19 34.98 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 123.167 1.46 . . . . 0.0 111.979 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 85.0 m -73.17 118.25 15.9 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.692 -1.255 . . . . 0.0 111.581 174.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -116.26 146.86 38.23 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.908 0.883 . . . . 0.0 111.011 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.81 153.19 76.32 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.693 2.262 . . . . 0.0 110.665 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.9 mt -59.75 -25.07 64.56 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -72.43 -21.16 61.29 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.608 1.163 . . . . 0.0 112.796 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -92.58 130.66 38.16 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.006 -1.059 . . . . 0.0 110.705 176.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.26 133.04 44.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.946 174.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.493 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 0.6 OUTLIER -168.7 178.45 4.66 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.025 0.53 . . . . 0.0 110.288 174.453 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttt -102.75 105.86 16.37 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 123.755 0.822 . . . . 0.0 110.618 175.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -122.14 137.81 54.69 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.285 1.034 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -80.56 136.5 36.27 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.535 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -48.67 -37.62 19.0 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.443 ' HB3' HD12 ' A' ' 57' ' ' LEU . . . -78.39 -29.29 47.2 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.788 0.835 . . . . 0.0 112.248 178.02 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -81.61 -30.23 32.96 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.503 0.721 . . . . 0.0 111.221 177.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.6 t -57.2 -29.61 63.85 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.427 1.491 . . . . 0.0 111.385 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.7 -33.72 66.73 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.334 1.054 . . . . 0.0 113.387 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.405 ' CB ' ' HB2' ' A' ' 40' ' ' CYS . 32.8 t -52.29 -61.03 2.53 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.149 0.979 . . . . 0.0 111.833 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.1 m -75.85 -52.43 10.38 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 37.8 -146.31 0.12 Allowed Glycine 0 C--N 1.344 1.016 0 C-N-CA 126.73 2.109 . . . . 0.0 111.455 -176.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mttp 45.81 43.91 10.35 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 119.944 1.872 . . . . 0.0 114.029 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.73 17.71 74.64 Favored Glycine 0 CA--C 1.539 1.566 0 O-C-N 121.544 -0.722 . . . . 0.0 114.899 -175.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -130.31 150.64 51.45 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.878 2.071 . . . . 0.0 109.612 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -115.78 158.81 22.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.584 1.554 . . . . 0.0 110.365 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 39.9 t -108.08 92.66 4.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.001 0.52 . . . . 0.0 111.041 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 48.7 t -81.96 163.84 21.89 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.774 0.321 . . . . 0.0 111.661 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 p -123.14 144.29 33.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.012 1.325 . . . . 0.0 111.693 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.493 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 46.1 m95 -111.86 -177.81 3.27 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.507 1.123 . . . . 0.0 111.859 173.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.4 pp -124.12 30.16 6.19 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.671 1.588 . . . . 0.0 112.947 179.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 116.176 -1.869 . . . . 0.0 111.766 -178.138 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -99.52 -29.94 12.44 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.53 -0.731 . . . . 0.0 110.89 -170.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 66.8 m -53.69 -54.49 37.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.712 1.205 . . . . 0.0 110.757 175.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -55.83 -38.07 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.052 1.341 . . . . 0.0 113.456 175.414 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.9 m -66.65 -23.66 66.18 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.303 1.041 . . . . 0.0 112.462 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 2.5 mmmm -97.03 -3.87 40.69 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 170.238 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.53 43.1 20.35 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.724 0.678 . . . . 0.0 112.319 -176.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 40.4 m-85 -105.63 159.21 16.14 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.54 1.17 . . . . 0.0 112.836 173.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.443 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -108.84 131.05 10.35 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.405 1.002 . . . . 0.0 111.796 -178.166 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.97 130.98 44.32 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.462 0.705 . . . . 0.0 111.86 172.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.1 mt -139.6 162.21 52.46 Favored Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 123.376 0.422 . . . . 0.0 110.782 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.498 ' HA ' HG21 ' A' ' 29' ' ' THR . 57.7 Cg_endo -68.07 138.95 45.25 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.48 2.12 . . . . 0.0 111.509 172.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -53.38 -14.91 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 174.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.27 -48.68 19.32 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.735 2.014 . . . . 0.0 112.218 170.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -76.04 -33.64 59.63 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.576 1.151 . . . . 0.0 112.071 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 29.8 t -86.67 115.32 61.91 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 120.917 -1.115 . . . . 0.0 111.406 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -62.68 152.35 78.64 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.17 1.914 . . . . 0.0 110.914 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -57.64 -19.39 26.17 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.901 0.88 . . . . 0.0 113.093 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -81.5 -25.82 35.67 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.498 1.919 . . . . 0.0 114.531 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -101.38 -15.17 17.3 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.912 1.685 . . . . 0.0 112.707 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -53.72 106.29 0.18 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.958 1.303 . . . . 0.0 111.874 172.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.562 HD21 ' CG ' ' A' ' 33' ' ' ASP . 16.0 mt -89.71 165.54 14.14 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 122.252 1.025 . . . . 0.0 111.738 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 t -116.78 21.4 13.39 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.404 1.482 . . . . 0.0 111.936 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.523 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 43.1 m-85 -63.27 -18.59 63.74 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 174.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.24 66.46 2.65 Favored Glycine 0 N--CA 1.474 1.224 0 CA-C-N 120.567 1.531 . . . . 0.0 113.713 176.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.02 31.87 0.29 Allowed Glycine 0 N--CA 1.462 0.428 0 O-C-N 120.905 -1.35 . . . . 0.0 114.038 -175.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 49.0 m -137.83 164.54 28.67 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.057 0.943 . . . . 0.0 112.955 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 t -61.22 -31.28 71.06 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.498 HG21 ' HA ' ' A' ' 12' ' ' PRO . 3.1 t -139.98 -58.17 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.066 1.346 . . . . 0.0 111.716 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.426 ' H ' HG23 ' A' ' 29' ' ' THR . 5.5 p -147.3 155.23 11.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 122.088 0.947 . . . . 0.0 110.755 174.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 74.0 m -95.53 141.42 29.08 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 172.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.429 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -122.03 137.24 54.88 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.248 1.019 . . . . 0.0 111.787 177.51 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.562 ' CG ' HD21 ' A' ' 22' ' ' LEU . 5.1 m-20 -74.23 103.86 4.8 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 122.082 0.944 . . . . 0.0 110.96 -178.417 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.563 HD22 ' HB3' ' A' ' 41' ' ' LYS . 44.5 mt -57.42 -43.34 83.74 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.967 -1.083 . . . . 0.0 111.749 178.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t -64.82 -33.35 75.8 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.467 1.107 . . . . 0.0 113.743 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -79.53 -37.4 36.64 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.882 0.873 . . . . 0.0 112.773 176.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.429 HD11 ' SG ' ' A' ' 32' ' ' CYS . 55.2 mt -64.68 -60.03 3.58 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 124.198 0.936 . . . . 0.0 110.814 177.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.7 t -173.83 145.63 1.16 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.373 0.669 . . . . 0.0 112.682 -177.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -52.93 -31.19 38.99 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 118.339 -1.256 . . . . 0.0 114.381 176.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.4 t -49.49 -51.76 33.9 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.568 1.684 . . . . 0.0 112.693 175.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.563 ' HB3' HD22 ' A' ' 34' ' ' LEU . 47.7 mttp -84.27 -36.75 22.43 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 122.982 0.513 . . . . 0.0 112.143 177.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.4 -36.8 64.1 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.083 0.849 . . . . 0.0 114.201 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -78.33 11.27 2.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.91 1.684 . . . . 0.0 113.448 172.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.39 18.59 63.4 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.239 1.876 . . . . 0.0 114.34 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.76 170.4 54.96 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 124.328 0.966 . . . . 0.0 112.742 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -137.96 142.61 40.5 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 122.733 1.254 . . . . 0.0 111.302 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.1 t -68.21 127.17 31.93 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.461 -0.774 . . . . 0.0 111.54 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -124.47 150.47 64.68 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 123.332 0.653 . . . . 0.0 111.887 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -71.12 157.44 57.55 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.384 2.056 . . . . 0.0 111.924 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -59.83 -27.35 66.56 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.45 -17.82 62.35 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.216 2.606 . . . . 0.0 113.08 176.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -88.14 129.17 35.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.944 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.88 121.36 21.74 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.272 0.629 . . . . 0.0 110.834 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -160.58 -176.93 5.86 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.989 1.316 . . . . 0.0 109.695 167.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.8 tppt? -92.71 126.08 37.63 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.904 1.282 . . . . 0.0 109.312 166.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.483 ' CD ' ' HE3' ' A' ' 69' ' ' LYS . 2.1 pm0 -124.9 146.98 49.07 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.325 1.45 . . . . 0.0 110.335 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -94.93 148.89 21.83 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.594 -0.691 . . . . 0.0 110.69 175.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -58.97 -42.56 90.2 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.0 0.92 . . . . 0.0 112.699 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.52 -30.09 57.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.3 1.04 . . . . 0.0 111.908 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.22 -37.44 20.09 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.053 0.941 . . . . 0.0 111.852 -178.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -58.07 -33.37 68.99 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.155 -1.591 . . . . 0.0 112.212 172.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.38 -41.69 72.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.54 0.736 . . . . 0.0 112.346 172.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.8 p -80.79 -19.65 44.3 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -63.82 -25.24 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.052 0.842 . . . . 0.0 111.619 174.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.11 163.12 16.72 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 122.419 1.011 . . . . 0.0 112.083 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.2 mttm -61.3 123.44 17.75 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.444 -1.033 . . . . 0.0 110.416 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.05 22.89 60.25 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.664 -1.076 . . . . 0.0 113.518 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -135.59 165.65 25.06 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.267 1.827 . . . . 0.0 111.452 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.483 ' HE3' ' CD ' ' A' ' 56' ' ' GLU . 54.6 mtpt -138.76 115.47 10.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.426 1.89 . . . . 0.0 111.941 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.3 t -73.39 104.94 4.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.91 -0.494 . . . . 0.0 110.921 -176.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.96 158.61 16.63 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.102 0.961 . . . . 0.0 110.994 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.7 m -132.48 145.41 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.712 1.605 . . . . 0.0 110.956 177.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -117.34 -71.81 0.72 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.736 1.214 . . . . 0.0 112.827 -176.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.6 166.57 6.66 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.494 1.518 . . . . 0.0 112.094 169.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.2 p80 . . . . . 0 C--O 1.245 0.849 0 C-N-CA 127.164 2.186 . . . . 0.0 116.639 -179.917 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASN . . . . . 0.429 ' HA ' ' O ' ' A' ' 25' ' ' GLY . 0.9 OUTLIER . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -123.59 -19.48 5.82 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.982 0.913 . . . . 0.0 112.625 -176.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.1 m -54.42 -63.92 1.0 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.016 -1.052 . . . . 0.0 111.056 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.1 p -56.3 -35.2 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.447 0.699 . . . . 0.0 112.703 177.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.4 m -60.65 -29.48 69.29 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.64 1.176 . . . . 0.0 112.002 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -97.15 -8.94 28.91 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 172.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.7 32.4 30.32 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.836 -0.98 . . . . 0.0 113.2 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -78.62 170.16 17.1 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.336 1.568 . . . . 0.0 112.549 174.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.753 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -112.82 116.12 3.91 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 125.321 1.439 . . . . 0.0 111.081 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.43 129.9 38.07 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.694 -0.886 . . . . 0.0 111.699 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.1 mt -143.13 159.08 57.14 Favored Pre-proline 0 C--O 1.22 -0.457 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.888 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.412 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 59.3 Cg_endo -68.55 144.97 62.73 Favored 'Trans proline' 0 C--O 1.217 -0.563 0 C-N-CA 123.407 2.738 . . . . 0.0 112.549 173.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.453 ' OE1' HG21 ' A' ' 30' ' ' VAL . 20.5 mm-40 -53.04 -18.97 2.36 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 177.135 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.0 t -72.55 -49.19 34.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.694 2.397 . . . . 0.0 111.77 169.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -76.79 -34.2 57.97 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.369 1.067 . . . . 0.0 110.59 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.0 t -95.21 115.34 65.33 Favored Pre-proline 0 C--O 1.242 0.686 0 O-C-N 120.608 -1.308 . . . . 0.0 111.633 -175.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -62.83 153.61 71.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.958 2.438 . . . . 0.0 110.746 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -53.44 -31.93 47.53 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.46 -18.13 61.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.834 1.254 . . . . 0.0 113.239 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.39 -23.45 15.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.32 1.448 . . . . 0.0 113.599 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -53.07 117.71 3.2 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.305 -0.872 . . . . 0.0 110.759 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.479 HD12 ' SG ' ' A' ' 31' ' ' CYS . 2.5 mt -103.35 172.2 6.95 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.375 1.084 . . . . 0.0 111.195 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -117.83 25.51 10.32 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.122 1.369 . . . . 0.0 112.336 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -70.66 -14.66 62.55 Favored 'General case' 0 C--O 1.211 -0.956 0 C-N-CA 123.528 0.731 . . . . 0.0 111.964 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.429 ' O ' ' HA ' ' A' ' 1' ' ' ASN . . . 53.33 85.19 0.02 OUTLIER Glycine 0 N--CA 1.469 0.858 0 CA-C-O 123.243 1.468 . . . . 0.0 113.627 175.372 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.16 29.51 0.02 OUTLIER Glycine 0 C--O 1.225 -0.458 0 O-C-N 120.604 -1.527 . . . . 0.0 114.202 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.7 m -129.7 158.71 38.62 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.475 1.11 . . . . 0.0 111.169 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.6 m -47.68 -48.57 29.09 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.399 1.08 . . . . 0.0 112.785 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -128.22 -59.03 1.19 Allowed 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.518 1.527 . . . . 0.0 110.961 179.62 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.453 HG21 ' OE1' ' A' ' 13' ' ' GLN . 7.6 p -145.06 145.14 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 122.886 1.327 . . . . 0.0 109.676 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.479 ' SG ' HD12 ' A' ' 22' ' ' LEU . 1.8 t -82.59 139.16 33.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.561 171.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.61 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -117.73 132.88 56.41 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.955 1.702 . . . . 0.0 110.781 174.782 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.455 ' HB3' HD21 ' A' ' 22' ' ' LEU . 0.7 OUTLIER -74.16 103.49 4.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 123.28 1.514 . . . . 0.0 112.319 176.27 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.753 HD21 ' HA3' ' A' ' 9' ' ' GLY . 16.6 mt -55.06 -42.25 72.49 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.697 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 t -59.24 -38.76 80.82 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.529 1.532 . . . . 0.0 113.205 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -77.06 -37.09 55.35 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.231 -0.89 . . . . 0.0 112.077 175.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.61 HD11 ' SG ' ' A' ' 32' ' ' CYS . 79.0 mt -63.67 -68.01 0.38 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.561 0.745 . . . . 0.0 110.021 176.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 30.8 p -151.17 168.78 23.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 122.858 1.313 . . . . 0.0 112.377 -175.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -83.23 -35.32 18.14 Favored Glycine 0 CA--C 1.525 0.707 0 O-C-N 119.373 -2.08 . . . . 0.0 112.819 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 46.3 t -51.08 -53.95 29.36 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 119.234 1.517 . . . . 0.0 111.006 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.499 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -72.8 -41.93 64.43 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.97 -36.66 74.71 Favored Glycine 0 CA--C 1.533 1.189 0 O-C-N 123.711 0.632 . . . . 0.0 113.247 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.3 mtmm -86.36 16.43 4.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.465 1.906 . . . . 0.0 114.137 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.12 47.69 79.23 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.46 1.028 . . . . 0.0 112.993 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -101.34 164.36 18.0 Favored Glycine 0 C--O 1.244 0.728 0 C-N-CA 124.799 1.19 . . . . 0.0 113.953 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -133.3 145.97 50.93 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.905 1.682 . . . . 0.0 110.625 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.9 m -73.28 121.04 19.73 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.088 -1.008 . . . . 0.0 111.113 175.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -120.23 150.01 50.63 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.998 0.919 . . . . 0.0 111.187 177.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -68.95 154.11 71.42 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.434 2.089 . . . . 0.0 110.553 176.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.498 HD23 ' HD3' ' A' ' 69' ' ' LYS . 82.7 mt -60.29 -20.83 60.74 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 174.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -70.54 -17.27 62.93 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.372 1.869 . . . . 0.0 111.952 173.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -92.94 132.35 37.13 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 120.667 -1.27 . . . . 0.0 110.44 177.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -90.05 119.29 30.28 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.627 0.771 . . . . 0.0 110.376 174.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -167.26 166.58 14.69 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.769 1.227 . . . . 0.0 110.241 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.3 tttt -71.48 112.11 7.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.477 1.111 . . . . 0.0 108.928 175.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.462 ' HG2' ' CE ' ' A' ' 69' ' ' LYS . 1.9 pp20? -120.15 142.85 48.58 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 124.003 0.921 . . . . 0.0 109.618 175.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -98.27 141.18 31.49 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.603 0.761 . . . . 0.0 111.191 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -62.21 -39.61 93.34 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.073 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.49 -32.34 58.27 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.707 0.765 . . . . 0.0 111.772 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.06 -35.56 56.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.9 t -52.18 -34.82 46.89 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.998 1.319 . . . . 0.0 112.359 174.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.97 63.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.242 1.017 . . . . 0.0 112.734 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 40.4 t -60.08 -54.98 39.51 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.037 1.735 . . . . 0.0 111.176 175.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 87.5 m -63.19 -43.17 98.97 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 117.88 176.85 17.2 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 122.716 1.175 . . . . 0.0 113.098 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -62.42 131.75 50.26 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.793 -0.828 . . . . 0.0 111.597 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.82 -2.87 82.68 Favored Glycine 0 CA--C 1.531 1.064 0 CA-C-O 118.345 -1.253 . . . . 0.0 113.942 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.2 164.12 16.72 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.396 1.878 . . . . 0.0 109.656 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.498 ' HD3' HD23 ' A' ' 50' ' ' LEU . 23.7 mtpt -133.55 125.09 28.1 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.239 1.816 . . . . 0.0 109.725 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 t -78.61 100.4 6.97 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 122.855 0.462 . . . . 0.0 111.035 176.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.47 136.66 38.27 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.648 0.737 . . . . 0.0 111.043 176.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.6 m -103.66 144.46 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.154 0.982 . . . . 0.0 111.21 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.8 m95 -104.91 -78.19 0.57 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.374 0.67 . . . . 0.0 111.326 179.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.9 mp -103.16 103.3 13.34 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.355 1.862 . . . . 0.0 107.662 178.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 116.634 -1.65 . . . . 0.0 115.022 174.664 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 CA--C 1.505 -0.773 0 CA-C-O 117.398 -1.287 . . . . 0.0 108.793 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -118.43 -29.5 5.46 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 124.8 1.312 . . . . 0.0 109.877 -177.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.3 m -56.91 -57.55 12.02 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 121.175 -0.953 . . . . 0.0 110.638 178.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.26 -33.01 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.66 -0.65 . . . . 0.0 112.384 177.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -62.29 -31.13 71.68 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.329 0.652 . . . . 0.0 111.28 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.41 ' HB2' ' CD2' ' A' ' 8' ' ' PHE . 28.3 mmtm -96.95 -10.44 26.32 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.24 45.5 4.08 Favored Glycine 0 C--O 1.222 -0.651 0 CA-C-O 118.423 -1.209 . . . . 0.0 111.324 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.506 ' CE2' ' CZ ' ' A' ' 24' ' ' TYR . 77.3 m-85 -108.27 163.25 13.35 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.121 0.96 . . . . 0.0 111.358 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 131.84 10.42 Favored Glycine 0 CA--C 1.523 0.536 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.781 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.8 m -80.43 118.99 22.54 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.048 177.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 30' ' ' VAL . 30.6 mt -132.93 154.95 81.6 Favored Pre-proline 0 C--O 1.211 -0.944 0 O-C-N 124.171 0.92 . . . . 0.0 112.025 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.52 141.21 72.67 Favored 'Trans proline' 0 C--O 1.213 -0.769 0 C-N-CA 124.394 3.396 . . . . 0.0 110.395 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.594 ' HA ' HG11 ' A' ' 30' ' ' VAL . 1.1 pt20 -49.79 -30.97 10.63 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.896 0.879 . . . . 0.0 112.594 177.014 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 t -65.85 -44.53 85.18 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.185 1.179 . . . . 0.0 114.185 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.408 ' OD1' HD13 ' A' ' 11' ' ' LEU . 8.2 t70 -70.5 -47.57 59.86 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.392 0.677 . . . . 0.0 112.363 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -86.0 128.74 56.84 Favored Pre-proline 0 CA--C 1.541 0.615 0 CA-C-O 121.422 0.629 . . . . 0.0 111.9 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -65.5 144.71 80.32 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.289 1.992 . . . . 0.0 110.958 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -51.85 -19.74 1.88 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 173.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -78.31 -36.11 46.92 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.779 0.832 . . . . 0.0 112.792 176.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.72 -28.31 26.4 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 116.026 -1.94 . . . . 0.0 110.776 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.535 ' HG2' HG21 ' A' ' 30' ' ' VAL . 84.0 mtt180 -44.14 119.82 1.92 Allowed 'General case' 0 C--N 1.345 0.396 0 O-C-N 125.105 1.503 . . . . 0.0 110.625 178.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.486 HD13 ' CE2' ' A' ' 24' ' ' TYR . 3.4 mt -103.18 178.4 4.57 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.2 p -121.35 30.26 6.86 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.157 0.983 . . . . 0.0 111.109 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.506 ' CZ ' ' CE2' ' A' ' 8' ' ' PHE . 62.7 m-85 -69.14 -19.18 64.02 Favored 'General case' 0 C--O 1.202 -1.409 0 CA-C-O 119.085 -0.483 . . . . 0.0 110.461 177.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.53 49.68 75.91 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 120.768 1.622 . . . . 0.0 111.804 178.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -143.23 36.67 1.56 Allowed Glycine 0 C--O 1.223 -0.592 0 CA-C-O 117.944 -1.476 . . . . 0.0 112.703 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 91.5 m -144.94 151.25 38.35 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 117.59 0.695 . . . . 0.0 111.4 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 p -63.22 -43.22 98.72 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 123.652 0.595 . . . . 0.0 111.558 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.1 p -105.93 -74.67 0.65 Allowed 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.001 0.52 . . . . 0.0 109.744 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.594 HG11 ' HA ' ' A' ' 13' ' ' GLN . 9.9 p -151.92 144.42 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 123.499 1.619 . . . . 0.0 111.336 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.8 t -80.34 128.24 33.33 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 120.594 -1.316 . . . . 0.0 111.059 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -106.43 138.27 42.92 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 124.049 0.843 . . . . 0.0 112.033 177.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.405 ' CB ' ' HE2' ' A' ' 36' ' ' LYS . 18.6 t0 -83.11 104.66 13.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.6 mt -65.26 -30.39 71.26 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 120.837 -1.164 . . . . 0.0 110.854 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 p -59.24 -36.67 75.88 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 120.484 -1.385 . . . . 0.0 112.634 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.405 ' HE2' ' CB ' ' A' ' 33' ' ' ASP . 31.4 mtmt -87.87 -35.53 17.7 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 123.54 0.525 . . . . 0.0 111.853 178.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.479 HD13 ' HA ' ' A' ' 37' ' ' LEU . 2.6 mm? -76.05 -71.98 0.35 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.233 0.613 . . . . 0.0 109.865 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -171.63 163.49 6.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 122.604 1.192 . . . . 0.0 111.462 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -94.53 32.28 6.13 Favored Glycine 0 C--O 1.212 -1.269 0 CA-C-O 116.846 -2.086 . . . . 0.0 113.512 175.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 47.3 t -47.95 -58.1 4.86 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.271 2.036 . . . . 0.0 111.901 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp -88.58 -40.03 13.67 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.146 179.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.68 -31.67 45.74 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 122.994 0.331 . . . . 0.0 112.854 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -77.05 14.53 0.85 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.69 32.87 85.64 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 123.958 0.789 . . . . 0.0 112.091 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.411 ' CA ' ' HA ' ' A' ' 72' ' ' VAL . . . -99.74 179.2 30.21 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 122.091 0.828 . . . . 0.0 113.168 178.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -146.8 153.67 40.46 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 123.218 1.485 . . . . 0.0 111.719 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.1 m -67.48 131.68 46.15 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.702 -1.249 . . . . 0.0 113.196 172.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -130.44 148.87 71.66 Favored Pre-proline 0 N--CA 1.452 -0.366 0 CA-C-O 121.65 0.738 . . . . 0.0 111.594 178.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.86 152.28 77.45 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.584 2.189 . . . . 0.0 111.405 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.634 HD23 ' HG3' ' A' ' 69' ' ' LYS . 12.9 mt -63.49 -18.96 64.34 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 176.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -81.34 -12.7 58.94 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.724 0.81 . . . . 0.0 111.399 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -94.19 136.09 34.86 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 120.965 -1.085 . . . . 0.0 110.444 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -86.19 123.2 31.21 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.986 176.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -169.74 -176.86 2.5 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.48 0.712 . . . . 0.0 111.156 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -97.4 109.02 21.86 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.611 0.764 . . . . 0.0 112.837 174.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -113.05 137.51 51.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.133 0.968 . . . . 0.0 110.987 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -83.28 145.34 29.15 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.53 176.237 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.404 ' N ' HD13 ' A' ' 57' ' ' LEU . 40.9 mm-40 -66.75 -42.59 85.95 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.594 0.711 . . . . 0.0 112.776 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.48 -32.53 64.35 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.474 -0.766 . . . . 0.0 111.869 177.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -78.22 -39.5 40.27 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.409 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.5 p -53.18 -32.62 48.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 124.721 1.209 . . . . 0.0 112.0 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.22 -30.28 64.44 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.1 p -61.36 -51.45 68.77 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 123.39 0.676 . . . . 0.0 111.665 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.4 t -66.23 -33.91 76.82 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.55 0.34 . . . . 0.0 110.117 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -178.92 27.99 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 123.291 1.495 . . . . 0.0 112.155 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -64.14 154.01 35.98 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.208 -1.172 . . . . 0.0 111.361 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.588 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 72.21 8.84 71.09 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.745 -178.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -143.06 157.24 44.71 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.048 0.939 . . . . 0.0 110.604 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.634 ' HG3' HD23 ' A' ' 50' ' ' LEU . 5.6 mtmp? -128.53 120.65 27.17 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.384 0.674 . . . . 0.0 111.001 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.3 t -80.15 102.09 9.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.212 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.19 168.26 14.14 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 175.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.411 ' HA ' ' CA ' ' A' ' 45' ' ' GLY . 8.0 p -128.43 144.44 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 C-N-CA 123.763 0.825 . . . . 0.0 111.237 177.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 23.8 m95 -121.04 177.06 5.27 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.89 0.852 . . . . 0.0 111.786 175.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 74' ' ' LEU . 3.1 mp -112.8 -4.01 14.09 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.113 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.6 m170 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 115.583 -2.151 . . . . 0.0 111.214 179.714 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 120.949 0.404 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -103.48 -37.63 7.5 Favored 'General case' 0 C--O 1.212 -0.883 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -46.26 -56.04 6.32 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 121.411 -0.806 . . . . 0.0 110.99 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.9 -23.88 21.97 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.634 0 CA-C-O 121.054 0.454 . . . . 0.0 111.681 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 t -64.66 -35.13 80.04 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 121.516 0.674 . . . . 0.0 111.203 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.497 ' HD3' ' CD2' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -97.23 -13.75 21.83 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.811 -0.556 . . . . 0.0 111.602 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.2 29.84 7.33 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 119.018 -0.879 . . . . 0.0 112.621 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.441 ' CD2' ' HB2' ' A' ' 6' ' ' LYS . 57.4 m-85 -85.38 173.89 9.96 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.374 0.587 . . . . 0.0 111.389 179.147 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.2 131.71 7.3 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.644 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.8 m -83.73 132.18 34.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 122.608 -0.348 . . . . 0.0 111.134 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.0 mt -151.24 154.66 34.11 Favored Pre-proline 0 C--O 1.199 -1.555 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.27 137.54 40.47 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.84 3.027 . . . . 0.0 111.626 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.405 ' CG ' HG11 ' A' ' 30' ' ' VAL . 87.2 mt-30 -46.82 -31.27 2.93 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 123.111 0.564 . . . . 0.0 110.437 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.7 t -57.78 -43.95 85.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 121.782 -0.574 . . . . 0.0 112.368 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -86.4 -33.66 20.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.548 0.69 . . . . 0.0 112.117 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.5 t -90.63 125.22 60.2 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-O 121.498 0.666 . . . . 0.0 111.345 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.47 148.93 74.13 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.024 2.482 . . . . 0.0 111.712 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -14.59 6.15 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.054 0.541 . . . . 0.0 111.844 177.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -85.82 -23.71 27.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.84 0.456 . . . . 0.0 112.116 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.405 ' HB1' ' H ' ' A' ' 33' ' ' ASP . . . -98.2 -25.41 14.9 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 122.74 0.416 . . . . 0.0 111.114 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.523 ' HD3' HG21 ' A' ' 30' ' ' VAL . 63.0 mtt180 -46.9 123.44 5.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.344 0.658 . . . . 0.0 110.3 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.0 mt -107.99 177.07 4.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.343 0.592 . . . . 0.0 110.406 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.8 m -133.04 36.36 3.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.816 0.817 . . . . 0.0 111.341 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.497 ' CD2' ' HD3' ' A' ' 6' ' ' LYS . 11.3 m-85 -71.54 -18.35 62.27 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 121.716 -0.615 . . . . 0.0 110.74 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.9 82.79 0.12 Allowed Glycine 0 C--O 1.22 -0.731 0 CA-C-O 122.83 1.239 . . . . 0.0 111.728 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 178.87 26.46 0.04 OUTLIER Glycine 0 C--O 1.22 -0.726 0 O-C-N 120.545 -1.562 . . . . 0.0 113.245 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 86.5 m -129.75 149.97 51.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.595 0.358 . . . . 0.0 111.477 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.4 p -63.97 -39.83 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.189 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.9 p -112.39 -75.22 0.61 Allowed 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 121.358 0.599 . . . . 0.0 110.627 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.523 HG21 ' HD3' ' A' ' 21' ' ' ARG . 7.1 p -152.99 134.11 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-O 123.387 1.565 . . . . 0.0 111.057 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 m -69.83 138.05 52.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 120.124 -1.61 . . . . 0.0 111.513 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.854 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.6 OUTLIER -114.12 148.77 36.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.151 0.501 . . . . 0.0 111.084 178.766 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.405 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 8.5 t70 -92.25 106.33 18.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.163 0.506 . . . . 0.0 110.848 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 mt -66.87 -35.0 79.03 Favored 'General case' 0 C--O 1.219 -0.548 0 O-C-N 121.849 -0.532 . . . . 0.0 110.879 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t -62.66 -38.71 91.38 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 122.58 0.352 . . . . 0.0 111.542 178.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -80.15 -36.23 35.43 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 122.762 0.425 . . . . 0.0 110.879 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.854 HD11 ' SG ' ' A' ' 32' ' ' CYS . 72.7 mt -66.4 -58.81 4.49 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.304 0.574 . . . . 0.0 110.491 -179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.504 HG21 ' OG ' ' A' ' 63' ' ' SER . 60.3 p -137.67 -176.3 4.37 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 122.394 1.093 . . . . 0.0 111.232 -179.068 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -119.96 2.17 13.25 Favored Glycine 0 C--O 1.225 -0.456 0 O-C-N 121.036 -1.04 . . . . 0.0 113.0 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -58.28 -51.79 68.31 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.535 0.683 . . . . 0.0 109.276 -176.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -38.27 79.59 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.79 179.005 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.82 -42.79 92.12 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -79.58 9.43 4.98 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.675 0.39 . . . . 0.0 111.658 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.17 38.85 24.91 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 112.337 -0.305 . . . . 0.0 112.337 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.94 173.37 19.09 Favored Glycine 0 N--CA 1.451 -0.35 0 O-C-N 122.591 -0.359 . . . . 0.0 112.506 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -151.71 157.32 41.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.158 0.98 . . . . 0.0 111.639 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 t -71.95 133.39 45.34 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 121.409 -0.807 . . . . 0.0 111.612 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -133.84 147.74 65.5 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 122.021 0.915 . . . . 0.0 111.65 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.28 156.19 66.6 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.943 2.429 . . . . 0.0 112.111 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.464 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 18.3 mt -60.25 -16.44 33.81 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.609 178.124 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -80.69 -14.38 58.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.425 0.631 . . . . 0.0 111.49 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -90.93 147.37 23.17 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 121.378 -0.826 . . . . 0.0 110.746 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -106.68 122.07 45.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.357 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -174.74 164.87 3.64 Favored 'General case' 0 C--O 1.2 -1.525 0 C-N-CA 122.739 0.415 . . . . 0.0 111.877 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm -75.25 113.4 12.57 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.637 -0.664 . . . . 0.0 110.296 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.21 132.57 46.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 122.188 0.994 . . . . 0.0 110.842 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 tp -80.96 132.29 35.39 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.084 -1.01 . . . . 0.0 110.588 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -55.88 -39.3 71.34 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 122.154 -0.341 . . . . 0.0 111.575 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.77 70.21 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.691 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -78.68 -36.72 43.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 122.411 0.285 . . . . 0.0 111.51 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 18.6 m -51.96 -37.79 54.24 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 123.411 0.684 . . . . 0.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.27 -28.36 58.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.504 ' OG ' HG21 ' A' ' 38' ' ' THR . 15.9 m -56.93 -58.27 8.9 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.237 0.615 . . . . 0.0 110.805 179.307 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.3 m -60.16 -37.97 81.76 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.137 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 119.31 -156.41 15.75 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-O 122.173 0.874 . . . . 0.0 111.871 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.5 pttt -89.25 133.14 34.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 O-C-N 121.614 -0.933 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 13.74 60.38 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 121.188 -0.529 . . . . 0.0 113.032 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -144.56 150.0 36.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.865 0.466 . . . . 0.0 111.034 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.464 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 16.5 mmtp -127.95 122.03 31.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.434 0.635 . . . . 0.0 111.456 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -78.47 110.51 13.61 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.822 -0.549 . . . . 0.0 111.431 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 95.6 m -99.46 162.61 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.509 0.671 . . . . 0.0 111.509 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.1 p -119.18 144.55 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.816 -0.553 . . . . 0.0 110.971 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 29.6 m95 -127.09 178.94 5.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.544 0.688 . . . . 0.0 111.056 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.591 ' H ' HD23 ' A' ' 74' ' ' LEU . 1.7 pt? -134.38 162.71 31.45 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.42 0.688 . . . . 0.0 111.177 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 C--O 1.246 0.874 0 CA-C-O 117.47 -1.252 . . . . 0.0 112.139 177.843 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 . . . . . 0 C--O 1.217 -0.634 0 CA-C-O 118.359 -0.829 . . . . 0.0 108.836 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -122.18 -34.75 3.26 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 124.27 0.981 . . . . 0.0 110.475 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -50.9 -48.05 60.6 Favored 'General case' 0 C--N 1.342 0.25 0 O-C-N 121.644 -0.66 . . . . 0.0 111.853 177.268 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.6 p -57.17 -29.96 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 t -71.17 -29.59 65.38 Favored 'General case' 0 C--O 1.23 0.043 0 C-N-CA 124.252 1.021 . . . . 0.0 111.247 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.473 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -94.02 -11.81 29.98 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 174.452 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.98 45.76 4.7 Favored Glycine 0 C--O 1.224 -0.504 0 O-C-N 124.339 1.025 . . . . 0.0 111.693 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.455 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 54.0 m-85 -111.21 163.75 13.59 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.401 1.101 . . . . 0.0 111.369 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.94 136.08 12.66 Favored Glycine 0 CA--C 1.522 0.504 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 83.3 m -80.56 125.36 29.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.621 176.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.633 HD13 ' OD2' ' A' ' 15' ' ' ASP . 48.7 mt -137.7 155.94 74.84 Favored Pre-proline 0 C--O 1.214 -0.799 0 O-C-N 124.01 0.819 . . . . 0.0 112.078 179.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.1 140.81 67.05 Favored 'Trans proline' 0 C--O 1.214 -0.697 0 C-N-CA 124.254 3.303 . . . . 0.0 110.255 178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.589 ' HA ' HG11 ' A' ' 30' ' ' VAL . 1.0 OUTLIER -49.5 -31.0 9.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.959 0.903 . . . . 0.0 112.745 176.68 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.0 t -66.13 -44.92 82.84 Favored 'General case' 0 C--O 1.224 -0.289 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.633 ' OD2' HD13 ' A' ' 11' ' ' LEU . 25.3 t70 -72.41 -44.97 61.71 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.571 0.748 . . . . 0.0 112.475 175.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' SG ' ' HB3' ' A' ' 20' ' ' ALA . 13.9 t -89.51 124.68 63.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 121.444 -0.785 . . . . 0.0 112.278 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -64.01 149.27 90.87 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.694 2.263 . . . . 0.0 111.206 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -54.2 -18.15 3.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -79.34 -32.66 43.35 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.968 0.907 . . . . 0.0 113.198 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.408 ' HB3' ' SG ' ' A' ' 16' ' ' CYS . . . -90.02 -23.2 21.55 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.686 177.444 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.656 ' HG2' HG21 ' A' ' 30' ' ' VAL . 95.4 mtt180 -45.48 116.49 1.17 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.938 0.895 . . . . 0.0 110.701 178.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.587 HD12 ' HB3' ' A' ' 31' ' ' CYS . 15.1 mt -95.52 177.27 5.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 122.339 1.066 . . . . 0.0 109.267 -178.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.1 m -130.4 28.68 4.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.192 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.473 ' CE1' ' HG3' ' A' ' 6' ' ' LYS . 37.7 m-85 -70.4 -19.36 63.01 Favored 'General case' 0 C--O 1.211 -0.936 0 O-C-N 121.891 -0.505 . . . . 0.0 111.525 177.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.89 78.87 0.26 Allowed Glycine 0 CA--C 1.527 0.839 0 CA-C-O 124.19 1.995 . . . . 0.0 111.555 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.29 27.88 0.09 OUTLIER Glycine 0 C--O 1.218 -0.86 0 O-C-N 118.968 -2.489 . . . . 0.0 112.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 84.5 m -135.62 143.48 45.58 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 117.863 0.831 . . . . 0.0 111.125 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.8 m -61.6 -33.99 74.86 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.519 1.137 . . . . 0.0 111.531 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 54.3 p -113.23 -76.0 0.59 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 123.184 0.593 . . . . 0.0 111.011 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.656 HG21 ' HG2' ' A' ' 21' ' ' ARG . 8.6 p -151.69 145.19 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 123.255 1.502 . . . . 0.0 111.261 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.587 ' HB3' HD12 ' A' ' 22' ' ' LEU . 1.9 m -81.17 137.04 35.93 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 120.07 -1.644 . . . . 0.0 110.303 175.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.07 141.08 46.18 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.654 0.782 . . . . 0.0 112.165 176.349 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.577 ' HB2' HD21 ' A' ' 22' ' ' LEU . 17.7 t0 -83.57 104.61 13.84 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.904 0.859 . . . . 0.0 110.434 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.487 HD22 ' HE2' ' A' ' 41' ' ' LYS . 60.7 mt -66.08 -32.61 74.17 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 121.432 -0.792 . . . . 0.0 110.992 177.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.1 m -66.05 -33.83 76.69 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 119.544 -1.973 . . . . 0.0 112.45 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -80.97 -35.62 31.88 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.075 0.55 . . . . 0.0 112.208 177.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.0 mp -89.31 -68.56 0.77 Allowed 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 121.392 0.615 . . . . 0.0 109.389 -178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.1 t -172.11 147.1 2.02 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 122.811 1.291 . . . . 0.0 112.992 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -104.91 31.3 8.73 Favored Glycine 0 C--O 1.212 -1.239 0 CA-C-O 117.986 -1.452 . . . . 0.0 112.405 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 53.9 t -52.36 -54.5 30.99 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 120.402 2.101 . . . . 0.0 111.535 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.487 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -85.15 -37.6 20.0 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 123.747 0.819 . . . . 0.0 112.087 177.679 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -62.48 -37.88 95.41 Favored Glycine 0 C--O 1.219 -0.808 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -177.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -78.87 15.93 0.99 Allowed 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.971 0.908 . . . . 0.0 112.508 174.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 65.89 30.54 77.33 Favored Glycine 0 CA--C 1.529 0.932 0 O-C-N 121.386 -0.821 . . . . 0.0 112.078 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.62 166.4 54.14 Favored Glycine 0 CA--C 1.524 0.653 0 O-C-N 122.033 -0.687 . . . . 0.0 112.388 177.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -144.44 154.73 43.25 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.656 1.217 . . . . 0.0 111.206 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.4 109.09 4.01 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.573 -0.704 . . . . 0.0 112.491 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -106.81 148.7 37.38 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 121.805 0.812 . . . . 0.0 111.993 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -67.14 153.54 77.21 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.55 2.167 . . . . 0.0 110.99 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.422 HD22 ' HE3' ' A' ' 69' ' ' LYS . 18.5 mt -60.21 -16.45 33.5 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 174.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -78.25 -18.21 55.65 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.098 0.959 . . . . 0.0 112.258 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -87.38 145.65 26.22 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.455 -1.403 . . . . 0.0 110.822 176.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -98.95 121.96 41.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.886 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -174.17 161.27 3.52 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 123.832 0.853 . . . . 0.0 111.202 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.19 110.52 6.7 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 122.702 0.401 . . . . 0.0 110.748 177.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.442 ' OE1' ' HB3' ' A' ' 61' ' ' SER . 0.8 OUTLIER -125.11 133.57 52.81 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.619 1.199 . . . . 0.0 110.112 178.191 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.531 HD23 ' HG2' ' A' ' 60' ' ' GLU . 22.1 tp -82.48 129.21 34.86 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 171.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -51.67 -40.01 59.28 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.441 -0.787 . . . . 0.0 113.002 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.45 -24.75 67.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.273 1.029 . . . . 0.0 111.998 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' HD23 ' A' ' 57' ' ' LEU . 27.2 mm-40 -91.17 -42.5 10.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.662 1.185 . . . . 0.0 113.489 176.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.442 ' HB3' ' OE1' ' A' ' 56' ' ' GLU . 24.8 p -52.24 -26.68 12.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.739 0.699 . . . . 0.0 112.82 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.27 85.16 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 175.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.5 t -67.33 -50.26 60.77 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.186 0.994 . . . . 0.0 111.635 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 10.8 m -51.71 -38.32 54.65 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.667 0.387 . . . . 0.0 112.043 178.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 121.08 156.36 9.78 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.808 1.227 . . . . 0.0 111.036 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -51.68 129.97 27.3 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.168 -1.195 . . . . 0.0 110.992 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.71 12.14 64.79 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -135.63 157.21 47.43 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 124.101 0.961 . . . . 0.0 110.445 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.422 ' HE3' HD22 ' A' ' 50' ' ' LEU . 73.7 mttt -135.17 120.58 19.14 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 124.834 1.253 . . . . 0.0 110.34 -178.69 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.78 98.84 0.56 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.447 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 65.8 m -97.31 159.85 14.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.738 1.256 . . . . 0.0 111.351 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -111.97 145.29 18.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 O-C-N 121.522 -0.736 . . . . 0.0 110.92 177.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.9 m95 -129.24 -3.17 5.0 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 117.609 -1.186 . . . . 0.0 113.889 178.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -24.79 121.25 0.05 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.826 1.65 . . . . 0.0 112.337 173.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 116.363 -1.78 . . . . 0.0 111.175 179.792 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 3.3 p30 . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -124.16 -24.85 4.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.559 0.744 . . . . 0.0 112.73 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.581 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 68.3 m -51.32 -60.16 3.43 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.732 1.213 . . . . 0.0 110.102 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -57.54 -33.71 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 175.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t -64.79 -26.87 68.53 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.983 1.313 . . . . 0.0 111.793 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 -10.65 23.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.505 174.078 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.15 30.83 21.64 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 124.32 0.962 . . . . 0.0 113.666 -177.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -82.39 165.32 20.39 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.249 1.024 . . . . 0.0 112.776 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.2 123.2 6.59 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.609 1.1 . . . . 0.0 111.721 178.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -72.85 131.53 42.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.636 -0.92 . . . . 0.0 111.878 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.5 mt -140.99 161.84 51.54 Favored Pre-proline 0 CA--C 1.535 0.369 0 O-C-N 124.007 0.817 . . . . 0.0 111.107 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.98 142.27 50.9 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.364 2.043 . . . . 0.0 111.067 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.45 -20.39 7.47 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -70.24 -46.81 63.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.049 1.34 . . . . 0.0 112.525 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.29 -39.08 49.25 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.334 1.053 . . . . 0.0 111.076 176.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.8 t -86.68 110.92 36.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 O-C-N 120.481 -1.387 . . . . 0.0 112.024 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -61.24 150.29 85.34 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.911 2.407 . . . . 0.0 110.434 -178.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -49.97 -23.68 2.15 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 176.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -72.46 -42.49 64.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.465 1.906 . . . . 0.0 111.818 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.26 -20.6 31.92 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.337 -1.316 . . . . 0.0 113.049 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -52.14 106.39 0.15 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.282 1.401 . . . . 0.0 111.802 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.703 HD21 ' HB2' ' A' ' 33' ' ' ASP . 17.0 mt -90.19 172.7 8.61 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.826 0.822 . . . . 0.0 111.259 -179.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 m -123.72 27.36 7.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 112.786 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.581 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 11.8 m-85 -71.75 -15.81 62.19 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.371 0.668 . . . . 0.0 111.489 178.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.99 80.43 0.09 OUTLIER Glycine 0 N--CA 1.468 0.818 0 CA-C-O 123.63 1.684 . . . . 0.0 112.432 175.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -178.39 28.27 0.06 OUTLIER Glycine 0 C--O 1.223 -0.587 0 O-C-N 120.509 -1.583 . . . . 0.0 114.904 -176.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 52.0 m -133.7 159.71 39.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 123.54 0.736 . . . . 0.0 110.981 175.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.2 m -52.39 -48.59 65.54 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 124.175 0.99 . . . . 0.0 112.927 -179.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.58 -61.52 1.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.34 1.456 . . . . 0.0 110.557 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.3 p -144.35 153.27 15.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.682 0.753 . . . . 0.0 111.294 176.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 82.9 m -90.77 136.5 33.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.741 0.816 . . . . 0.0 109.109 171.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.582 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -114.29 137.37 51.88 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.995 1.318 . . . . 0.0 111.821 174.904 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.703 ' HB2' HD21 ' A' ' 22' ' ' LEU . 19.5 t0 -81.71 101.52 10.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.027 -179.588 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 mt -62.75 -35.53 80.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.954 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.3 t -61.63 -38.94 89.51 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.524 1.53 . . . . 0.0 111.522 176.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -80.07 -36.66 35.26 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 177.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.582 HD11 ' SG ' ' A' ' 32' ' ' CYS . 55.7 mt -61.63 -60.29 3.9 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.336 1.054 . . . . 0.0 109.945 178.311 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.2 p -148.93 164.36 34.75 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.178 0.989 . . . . 0.0 112.502 -175.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -80.67 -23.63 59.79 Favored Glycine 0 CA--C 1.529 0.96 0 O-C-N 119.954 -1.716 . . . . 0.0 113.782 177.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.1 t -47.8 -55.48 9.58 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.678 1.739 . . . . 0.0 113.09 -176.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.1 mmtp -71.31 -40.2 70.97 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.32 -38.37 61.96 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 123.44 0.543 . . . . 0.0 113.372 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.3 mttm -80.15 11.84 3.22 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.943 1.697 . . . . 0.0 114.061 174.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.36 30.78 72.09 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.594 1.092 . . . . 0.0 113.276 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.64 163.7 40.7 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 123.507 0.575 . . . . 0.0 112.69 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -125.87 144.7 50.56 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.469 1.507 . . . . 0.0 111.115 -178.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.25 128.88 38.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 121.132 -0.98 . . . . 0.0 110.332 176.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -130.74 146.8 63.53 Favored Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 121.45 -0.781 . . . . 0.0 111.654 177.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -66.06 157.86 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.368 2.045 . . . . 0.0 110.428 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.3 mt -62.08 -22.2 65.58 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -77.86 -13.43 59.89 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.646 1.578 . . . . 0.0 113.078 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -87.49 135.46 33.34 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 120.429 -1.419 . . . . 0.0 110.0 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -99.94 123.51 44.26 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.238 1.415 . . . . 0.0 110.371 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -165.65 178.55 6.58 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 125.275 1.43 . . . . 0.0 109.805 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -80.42 110.42 15.85 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 121.446 -0.784 . . . . 0.0 110.302 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -121.9 133.31 54.86 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.452 1.101 . . . . 0.0 111.35 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.561 HD23 ' OE1' ' A' ' 60' ' ' GLU . 13.3 tp -88.44 133.63 34.07 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.914 -1.116 . . . . 0.0 109.344 173.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -50.3 -40.38 48.41 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.029 1.732 . . . . 0.0 113.813 172.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.6 -25.75 66.77 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.791 1.236 . . . . 0.0 112.381 176.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.561 ' OE1' HD23 ' A' ' 57' ' ' LEU . 1.1 mp0 -94.13 -28.49 15.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.233 1.013 . . . . 0.0 112.718 174.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.0 t -51.66 -38.5 55.19 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 125.658 1.583 . . . . 0.0 111.638 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.14 -44.13 67.52 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.289 1.436 . . . . 0.0 113.474 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 t -44.58 -55.96 4.73 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.138 1.775 . . . . 0.0 112.753 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 18.0 m -77.12 -58.48 3.26 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.485 172.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 36.87 -146.07 0.08 OUTLIER Glycine 0 N--CA 1.472 1.057 0 C-N-CA 128.504 2.954 . . . . 0.0 112.255 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 pttt 42.05 42.83 2.53 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 121.142 2.471 . . . . 0.0 117.174 172.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 86.26 17.05 61.47 Favored Glycine 0 CA--C 1.542 1.726 0 N-CA-C 115.36 0.904 . . . . 0.0 115.36 -174.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -142.16 152.55 43.3 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.042 2.537 . . . . 0.0 109.957 -177.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -129.09 160.84 31.54 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.842 -1.161 . . . . 0.0 109.986 176.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 47.6 t -97.91 107.41 19.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.394 0.678 . . . . 0.0 110.779 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.41 152.1 23.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.167 0.508 . . . . 0.0 110.978 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -117.93 146.8 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.093 0.957 . . . . 0.0 110.986 176.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -107.88 -73.34 0.69 Allowed 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.112 0.965 . . . . 0.0 111.771 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.68 175.41 4.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.034 0.921 . . . . 0.0 110.672 177.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 p80 . . . . . 0 C--O 1.253 1.264 0 CA-C-O 116.639 -1.648 . . . . 0.0 111.798 175.648 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -117.71 -32.41 4.85 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.337 -173.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -50.16 -48.22 54.02 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.409 0.683 . . . . 0.0 111.823 176.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.29 -33.91 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 124.78 1.232 . . . . 0.0 113.21 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -68.39 -28.18 66.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.138 1.375 . . . . 0.0 112.066 177.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -96.57 -5.69 38.62 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.04 40.84 28.92 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.862 0.755 . . . . 0.0 113.533 -176.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.51 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 57.0 m-85 -94.9 167.21 11.56 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.334 1.054 . . . . 0.0 112.918 172.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.51 127.5 7.89 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.437 1.018 . . . . 0.0 111.627 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.6 m -72.41 134.29 45.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.782 -0.834 . . . . 0.0 111.865 171.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 33.0 mt -142.73 163.47 38.38 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.257 175.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.504 ' HA ' HG21 ' A' ' 29' ' ' THR . 58.2 Cg_endo -68.55 137.51 39.43 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.116 2.544 . . . . 0.0 112.203 172.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -52.75 -17.1 1.17 Allowed 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -46.44 56.49 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.342 1.857 . . . . 0.0 112.041 171.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.05 -35.98 28.18 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.581 1.152 . . . . 0.0 112.107 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.5 t -87.26 109.47 25.77 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.757 -1.215 . . . . 0.0 112.08 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.06 150.66 87.64 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.933 2.422 . . . . 0.0 111.509 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -55.05 -18.38 5.22 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -78.74 -33.16 46.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.525 1.53 . . . . 0.0 112.931 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.81 -17.15 23.41 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.52 1.528 . . . . 0.0 112.666 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -51.75 109.48 0.36 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.09 0.956 . . . . 0.0 111.873 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 36.9 mt -86.03 170.54 12.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.915 0.864 . . . . 0.0 111.882 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.3 t -120.13 22.05 11.56 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.961 1.305 . . . . 0.0 112.224 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.51 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 60.4 m-85 -70.29 -19.68 63.08 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 175.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.26 73.04 0.5 Allowed Glycine 0 N--CA 1.471 0.985 0 O-C-N 120.608 -1.308 . . . . 0.0 113.684 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -167.02 30.19 0.19 Allowed Glycine 0 N--CA 1.464 0.507 0 O-C-N 120.407 -1.643 . . . . 0.0 114.163 -176.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 59.9 m -130.55 163.22 27.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.195 0.998 . . . . 0.0 112.109 178.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.0 m -59.08 -31.43 68.88 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.837 1.255 . . . . 0.0 113.198 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.504 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.6 t -144.75 -55.22 0.33 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.605 1.162 . . . . 0.0 111.933 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 29' ' ' THR . 5.3 p -146.27 151.24 14.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-O 122.357 1.075 . . . . 0.0 110.945 174.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 14.2 m -87.83 139.11 30.85 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.233 1.013 . . . . 0.0 108.646 170.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.422 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -117.4 136.52 53.12 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.669 0.788 . . . . 0.0 112.042 174.726 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -78.49 102.77 8.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.849 0.833 . . . . 0.0 111.672 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.9 mt -58.34 -38.2 76.68 Favored 'General case' 0 C--O 1.221 -0.44 0 O-C-N 121.686 -0.634 . . . . 0.0 111.642 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 t -61.52 -37.31 83.26 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.343 1.057 . . . . 0.0 111.819 178.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.0 mtpt -77.48 -41.64 38.75 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 175.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.422 HD11 ' SG ' ' A' ' 32' ' ' CYS . 50.5 mt -63.53 -59.78 4.19 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.46 0.704 . . . . 0.0 111.218 177.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -172.83 144.61 1.35 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 123.324 1.535 . . . . 0.0 113.774 -174.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -79.68 7.97 51.52 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 116.874 -2.07 . . . . 0.0 115.597 174.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.9 t -56.95 -55.34 35.92 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 122.511 3.155 . . . . 0.0 111.341 -165.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.65 -28.98 56.22 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.87 1.268 . . . . 0.0 113.65 171.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -78.83 -27.05 57.43 Favored Glycine 0 CA--C 1.535 1.302 0 O-C-N 121.309 -0.87 . . . . 0.0 114.91 -173.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.78 9.08 12.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.187 2.595 . . . . 0.0 112.713 173.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 83.58 31.21 27.86 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.617 1.58 . . . . 0.0 114.206 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -113.79 179.91 18.93 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.332 1.066 . . . . 0.0 113.112 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -150.52 157.13 42.66 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.807 0.843 . . . . 0.0 111.152 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.0 t -63.5 126.86 28.88 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.046 -1.034 . . . . 0.0 110.807 174.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -124.92 152.89 70.75 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.17 0.988 . . . . 0.0 111.357 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.18 156.76 46.68 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.356 2.037 . . . . 0.0 111.524 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.0 mt -62.52 -24.42 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 178.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -71.8 -19.52 61.99 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.891 1.276 . . . . 0.0 113.747 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -79.24 127.47 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.981 -1.074 . . . . 0.0 110.522 173.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -91.13 117.62 29.76 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.715 0.806 . . . . 0.0 111.498 172.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.66 174.39 10.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.988 176.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 tptt -72.93 124.68 25.92 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.44 -0.788 . . . . 0.0 109.236 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -123.79 142.16 51.36 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 124.808 1.243 . . . . 0.0 110.214 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.75 152.36 19.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.852 0.834 . . . . 0.0 110.355 174.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 mp0 -73.24 -38.6 65.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.389 -0.819 . . . . 0.0 110.648 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.18 58.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.317 0.647 . . . . 0.0 112.638 177.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -82.48 -43.16 17.55 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.909 0.884 . . . . 0.0 111.111 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.2 p -58.25 -31.88 67.82 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.959 -1.713 . . . . 0.0 112.096 178.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.75 -38.24 64.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.975 1.31 . . . . 0.0 113.341 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -57.96 -49.14 77.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.72 1.608 . . . . 0.0 114.107 -176.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 m -75.73 -59.16 2.87 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 169.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 38.8 -143.6 0.3 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 126.077 1.799 . . . . 0.0 112.017 -175.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? 48.23 35.56 5.63 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.02 1.859 . . . . 0.0 116.02 171.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.26 21.19 42.4 Favored Glycine 0 CA--C 1.538 1.486 0 N-CA-C 115.174 0.83 . . . . 0.0 115.174 -172.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -136.78 157.0 47.77 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.342 2.257 . . . . 0.0 111.373 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -134.49 142.17 46.97 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.399 1.88 . . . . 0.0 109.724 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.4 m -86.8 115.45 24.23 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 120.823 -1.173 . . . . 0.0 110.015 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 18.3 m -110.41 152.1 26.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.449 0.642 . . . . 0.0 112.155 176.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.2 p -123.66 143.9 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.601 0.761 . . . . 0.0 110.475 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.5 m95 -104.06 179.11 4.37 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.465 1.106 . . . . 0.0 110.939 175.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.3 mt -54.84 125.08 18.66 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.254 1.022 . . . . 0.0 110.727 167.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.1 m170 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 115.738 -2.077 . . . . 0.0 112.173 174.551 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 5.3 p30 . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -120.38 -30.58 4.54 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.513 1.133 . . . . 0.0 112.033 -173.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.588 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 86.0 m -51.96 -46.71 64.88 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.514 1.126 . . . . 0.0 111.4 176.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.81 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.799 1.24 . . . . 0.0 112.023 176.077 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.2 t -67.63 -23.89 65.4 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.242 1.017 . . . . 0.0 112.093 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.444 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.3 OUTLIER -99.32 -2.12 37.19 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 171.802 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.18 31.92 58.93 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 118.578 -1.124 . . . . 0.0 113.179 -178.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 45.4 m-85 -88.01 166.74 14.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.275 1.43 . . . . 0.0 112.636 174.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.11 129.25 8.01 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 125.021 1.296 . . . . 0.0 110.835 -178.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.4 m -69.16 124.8 24.77 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.066 0.546 . . . . 0.0 111.578 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 mt -131.57 162.73 54.39 Favored Pre-proline 0 CA--C 1.538 0.507 0 O-C-N 124.084 0.865 . . . . 0.0 110.861 174.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.47 138.51 35.73 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 123.003 2.468 . . . . 0.0 110.576 172.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -52.51 -18.38 1.67 Allowed 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.1 t -74.5 -45.33 46.61 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.63 1.972 . . . . 0.0 112.533 171.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -74.99 -43.16 55.51 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.357 1.063 . . . . 0.0 110.971 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.7 t -84.82 119.23 72.48 Favored Pre-proline 0 C--O 1.242 0.698 0 C-N-CA 123.348 0.659 . . . . 0.0 111.906 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.4 148.23 92.86 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.471 2.114 . . . . 0.0 110.869 -178.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -49.98 -28.08 6.33 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 173.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.02 -32.84 67.54 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 174.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.38 -17.87 26.49 Favored 'General case' 0 N--CA 1.46 0.064 0 C-N-CA 125.349 1.46 . . . . 0.0 113.539 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.417 ' HG2' HG21 ' A' ' 30' ' ' VAL . 90.4 mtt180 -51.72 105.91 0.13 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.479 -0.763 . . . . 0.0 111.443 173.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' ' 31' ' ' CYS . 47.3 mt -84.64 167.33 16.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.487 1.137 . . . . 0.0 111.194 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 p -116.59 18.18 15.09 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.822 1.649 . . . . 0.0 112.426 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.588 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 51.2 m-85 -66.93 -9.21 35.81 Favored 'General case' 0 C--O 1.211 -0.921 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.17 57.37 19.5 Favored Glycine 0 N--CA 1.472 1.095 0 O-C-N 120.444 -1.41 . . . . 0.0 113.098 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -147.22 23.55 1.57 Allowed Glycine 0 C--O 1.226 -0.404 0 CA-C-O 118.767 -1.018 . . . . 0.0 115.575 -172.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 58.8 m -141.39 143.6 34.04 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.216 1.006 . . . . 0.0 111.134 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.3 m -50.24 -43.87 53.17 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.837 1.255 . . . . 0.0 113.37 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.52 -73.49 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.508 1.923 . . . . 0.0 110.509 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.417 HG21 ' HG2' ' A' ' 21' ' ' ARG . 9.4 p -148.09 153.8 11.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 123.839 0.856 . . . . 0.0 111.015 177.108 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 88.1 m -91.53 133.94 35.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.64 138.62 45.73 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.762 1.225 . . . . 0.0 112.038 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.614 ' OD2' ' HE2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -81.4 95.95 7.2 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 122.912 1.339 . . . . 0.0 114.415 178.953 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.15 -37.31 86.7 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 120.718 -1.239 . . . . 0.0 110.927 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.8 p -66.28 -36.61 83.41 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.008 -1.683 . . . . 0.0 113.263 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.614 ' HE2' ' OD2' ' A' ' 33' ' ' ASP . 15.6 mtmm -80.53 -35.59 34.31 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.361 1.465 . . . . 0.0 113.342 177.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.4 mt -89.95 -75.78 0.44 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.815 1.246 . . . . 0.0 110.71 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.9 t -161.72 139.04 8.66 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.032 1.333 . . . . 0.0 112.684 -177.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -112.99 52.88 0.61 Allowed Glycine 0 CA--C 1.521 0.44 0 CA-C-O 118.187 -1.34 . . . . 0.0 112.32 -178.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.406 ' HB2' ' HG2' ' A' ' 60' ' ' GLU . 15.1 t -47.77 -59.92 2.95 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.267 1.034 . . . . 0.0 110.257 -179.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.56 -34.84 38.54 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 175.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.95 -37.43 60.57 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.567 1.08 . . . . 0.0 112.226 -178.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -80.28 8.09 8.17 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.099 1.36 . . . . 0.0 113.809 174.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.68 19.27 52.44 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.195 1.379 . . . . 0.0 114.069 -177.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.39 150.26 26.97 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 125.138 1.351 . . . . 0.0 112.77 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -140.55 145.65 37.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 124.657 1.183 . . . . 0.0 110.322 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 91.4 m -71.77 114.3 9.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.522 0.729 . . . . 0.0 111.912 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -117.33 148.72 43.24 Favored Pre-proline 0 C--O 1.241 0.618 0 C-N-CA 124.172 0.989 . . . . 0.0 110.581 -179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.79 152.7 77.22 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 121.86 1.706 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.3 mt -60.61 -18.4 52.87 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.56 -24.27 56.66 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.049 1.739 . . . . 0.0 112.844 171.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -78.26 143.29 37.18 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 119.961 -1.712 . . . . 0.0 110.582 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -102.75 120.72 41.09 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 124.535 1.134 . . . . 0.0 111.371 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.6 p -169.5 173.23 6.57 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.236 1.414 . . . . 0.0 110.943 175.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -76.0 102.26 5.57 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.89 1.276 . . . . 0.0 110.955 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -118.73 139.64 51.23 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.49 1.116 . . . . 0.0 110.342 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 17.8 mt -87.92 126.31 34.98 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 123.106 0.563 . . . . 0.0 110.171 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -60.62 -39.35 87.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.335 0.654 . . . . 0.0 111.816 -178.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.34 -26.57 58.69 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.117 0.967 . . . . 0.0 113.023 175.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.406 ' HG2' ' HB2' ' A' ' 40' ' ' CYS . 7.3 tt0 -88.67 -22.33 23.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.225 1.01 . . . . 0.0 112.327 179.599 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.8 p -54.91 -29.3 55.72 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.968 1.707 . . . . 0.0 112.708 175.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.64 49.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.328 1.451 . . . . 0.0 113.053 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.1 m -55.23 -42.77 73.85 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 174.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 73.8 m -80.37 -36.62 33.72 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.821 0.448 . . . . 0.0 111.678 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 110.36 170.39 19.75 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 122.954 1.308 . . . . 0.0 112.514 179.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -56.26 134.87 53.59 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.749 -1.442 . . . . 0.0 111.092 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.13 5.4 65.85 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.977 -0.902 . . . . 0.0 114.054 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -140.99 163.63 32.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.843 2.057 . . . . 0.0 110.225 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -123.9 162.05 24.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.76 1.624 . . . . 0.0 110.151 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -123.7 97.48 5.4 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.566 0.747 . . . . 0.0 110.95 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 93.8 m -97.72 138.67 34.76 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.338 1.055 . . . . 0.0 110.157 -178.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -105.17 145.76 13.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 124.136 0.974 . . . . 0.0 111.369 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.7 m95 -121.13 172.62 7.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 122.139 0.971 . . . . 0.0 110.839 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -59.94 165.8 3.05 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.751 167.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 66.8 m80 . . . . . 0 C--O 1.253 1.251 0 CA-C-O 115.598 -2.144 . . . . 0.0 112.972 175.601 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 121.004 0.43 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -49.6 -58.28 5.55 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.985 0.914 . . . . 0.0 111.477 177.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.63 -31.22 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.322 0.649 . . . . 0.0 112.438 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.67 -29.45 69.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.636 1.174 . . . . 0.0 111.318 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 2.1 mmmp? -96.7 -9.53 28.87 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 117.286 -1.34 . . . . 0.0 114.169 174.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 84.25 34.42 17.38 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 125.107 1.504 . . . . 0.0 112.541 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.524 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 59.1 m-85 -87.58 170.53 11.23 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.985 1.314 . . . . 0.0 112.574 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.72 123.9 5.85 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.794 -0.923 . . . . 0.0 110.794 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -74.26 131.59 41.33 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 118.799 -0.62 . . . . 0.0 111.252 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 mt -144.72 160.67 46.54 Favored Pre-proline 0 CA--C 1.53 0.199 0 O-C-N 124.075 0.859 . . . . 0.0 111.071 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.624 ' HA ' HG21 ' A' ' 29' ' ' THR . 55.4 Cg_endo -67.07 137.73 45.25 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.484 2.789 . . . . 0.0 110.913 174.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.497 ' HA ' HG11 ' A' ' 30' ' ' VAL . 66.9 mt-30 -52.08 -23.17 4.9 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 175.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 t -70.38 -46.44 64.06 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 124.257 1.023 . . . . 0.0 113.208 171.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -72.85 -41.17 65.06 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.957 0.903 . . . . 0.0 110.197 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.1 t -85.38 124.44 71.69 Favored Pre-proline 0 CA--C 1.541 0.622 0 O-C-N 120.591 -1.318 . . . . 0.0 111.715 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -62.71 145.73 95.05 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.696 2.264 . . . . 0.0 110.494 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -52.87 -21.33 4.14 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.72 -34.08 40.35 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.671 1.588 . . . . 0.0 112.62 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.61 -25.14 28.79 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 117.881 -1.056 . . . . 0.0 112.481 177.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -49.18 111.35 0.47 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.176 0.898 . . . . 0.0 110.933 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.7 mt -93.8 174.71 7.04 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.725 0.774 . . . . 0.0 109.879 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 m -115.14 25.24 11.03 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.009 1.324 . . . . 0.0 111.86 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.524 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 52.0 m-85 -67.93 -11.72 59.3 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.865 175.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 45.0 80.42 0.05 OUTLIER Glycine 0 N--CA 1.473 1.166 0 CA-C-N 120.882 1.673 . . . . 0.0 114.404 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 177.64 27.73 0.04 OUTLIER Glycine 0 C--O 1.226 -0.355 0 O-C-N 120.643 -1.504 . . . . 0.0 113.401 -174.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.7 m -125.89 159.26 33.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.762 0.825 . . . . 0.0 110.872 176.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.4 p -43.18 -43.58 4.73 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.463 1.105 . . . . 0.0 112.899 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.624 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.3 t -137.81 -61.82 0.61 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.963 1.705 . . . . 0.0 111.311 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.542 ' H ' HG23 ' A' ' 29' ' ' THR . 7.8 p -138.57 151.62 24.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 122.132 0.968 . . . . 0.0 110.387 179.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -90.76 134.1 34.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.26 173.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.81 141.26 41.09 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.113 0.965 . . . . 0.0 111.826 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -81.32 103.19 10.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.46 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.4 mt -63.61 -32.71 74.26 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 121.063 -1.023 . . . . 0.0 110.825 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.5 t . . . . . 0 N--CA 1.466 0.36 0 O-C-N 119.352 -2.093 . . . . 0.0 112.709 176.694 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.4 mttm . . . . . 0 N--CA 1.468 0.449 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.71 -34.98 79.44 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-O 119.695 -0.503 . . . . 0.0 113.354 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -80.07 14.82 1.7 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.627 1.171 . . . . 0.0 113.781 173.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.05 45.15 52.36 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 123.791 0.71 . . . . 0.0 113.265 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -124.43 159.66 19.05 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.594 1.568 . . . . 0.0 112.764 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -147.51 153.55 39.65 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.676 1.227 . . . . 0.0 111.477 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.2 m -64.34 124.31 21.41 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.927 -1.108 . . . . 0.0 112.507 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -122.64 147.97 51.96 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-O 122.019 0.914 . . . . 0.0 111.258 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.23 153.24 71.68 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.212 1.941 . . . . 0.0 110.416 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.641 HD22 ' HE3' ' A' ' 69' ' ' LYS . 21.5 mt -60.08 -22.06 62.25 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 175.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.66 -18.59 60.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.015 1.326 . . . . 0.0 112.591 175.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.9 tpp85 -87.27 127.66 35.17 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.454 176.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.03 119.38 19.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.742 175.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.2 t -165.69 176.05 8.34 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.214 1.006 . . . . 0.0 110.401 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -96.91 110.45 22.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.779 1.231 . . . . 0.0 110.466 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -111.01 138.12 47.81 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.455 1.102 . . . . 0.0 110.727 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 13.2 mt -89.16 153.2 21.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.455 -0.778 . . . . 0.0 110.433 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -63.92 -36.28 83.41 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.416 -0.802 . . . . 0.0 112.102 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.1 50.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.486 0.714 . . . . 0.0 112.285 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -81.24 -33.61 32.7 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.2 m -56.27 -31.46 63.62 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.051 -1.031 . . . . 0.0 112.16 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -40.08 70.11 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.338 1.055 . . . . 0.0 112.746 175.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -48.0 -58.64 4.17 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.423 1.489 . . . . 0.0 111.938 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.7 m -64.36 -49.64 70.86 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.593 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.13 -169.68 12.97 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-O 123.097 1.387 . . . . 0.0 112.759 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -64.94 136.74 57.18 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.713 -1.463 . . . . 0.0 111.73 177.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.05 5.33 89.33 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 119.328 -0.707 . . . . 0.0 113.56 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -136.89 161.14 36.82 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.734 1.214 . . . . 0.0 110.951 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.641 ' HE3' HD22 ' A' ' 50' ' ' LEU . 43.9 mttt -138.47 121.4 16.61 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.759 1.224 . . . . 0.0 110.659 -178.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.6 t -73.8 106.92 5.74 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.7 -0.625 . . . . 0.0 111.048 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.457 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.9 OUTLIER -91.21 151.84 20.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.402 0.62 . . . . 0.0 110.662 177.153 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.75 145.48 34.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 124.209 1.003 . . . . 0.0 110.601 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.457 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 47.2 m95 . . . . . 0 C--O 1.222 -0.37 0 CA-C-O 121.569 0.699 . . . . 0.0 111.51 175.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.472 0.672 0 CA-C-O 120.754 0.311 . . . . 0.0 111.732 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.554 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 63.3 m -51.5 -56.61 12.44 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.743 1.217 . . . . 0.0 110.201 176.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.18 -32.06 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.532 1.133 . . . . 0.0 113.827 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.5 t -61.23 -33.73 73.97 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.063 1.345 . . . . 0.0 111.37 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -96.03 -5.82 40.17 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 82.61 30.06 34.0 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-O 117.695 -1.614 . . . . 0.0 113.347 -177.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -75.11 168.66 19.56 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.458 1.629 . . . . 0.0 112.936 174.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.81 114.63 3.17 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.293 1.425 . . . . 0.0 111.435 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.5 m -66.04 131.45 46.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.748 172.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.418 ' O ' HG13 ' A' ' 30' ' ' VAL . 51.8 mt -145.11 155.63 54.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 124.04 0.838 . . . . 0.0 111.496 176.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.499 ' HA ' HG21 ' A' ' 29' ' ' THR . 58.2 Cg_endo -63.43 138.27 64.66 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.509 2.139 . . . . 0.0 110.587 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -25.55 1.99 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 p -71.09 -41.17 70.98 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.998 0.919 . . . . 0.0 112.921 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -78.91 -46.22 18.92 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.822 1.649 . . . . 0.0 111.567 176.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.3 t -88.08 121.67 70.41 Favored Pre-proline 0 C--O 1.244 0.799 0 C-N-CA 124.142 0.977 . . . . 0.0 111.485 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -61.47 144.5 98.06 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.74 2.293 . . . . 0.0 110.5 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.2 pp0? -47.38 -30.12 3.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.214 1.006 . . . . 0.0 113.688 175.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -69.7 -32.97 71.87 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.962 1.305 . . . . 0.0 113.739 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.67 -20.42 21.62 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.749 1.22 . . . . 0.0 112.506 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.518 ' HG2' HG21 ' A' ' 30' ' ' VAL . 73.5 mtt180 -51.1 100.34 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 112.272 173.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 41.9 mt -84.28 166.41 17.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.967 0.889 . . . . 0.0 111.214 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -113.79 29.3 8.1 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.184 1.794 . . . . 0.0 112.277 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.554 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 15.2 m-85 -68.17 -17.95 64.48 Favored 'General case' 0 C--O 1.211 -0.944 0 O-C-N 121.255 -0.903 . . . . 0.0 112.57 175.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.1 74.38 0.41 Allowed Glycine 0 N--CA 1.473 1.11 0 CA-C-O 123.767 1.759 . . . . 0.0 113.29 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.73 36.54 0.07 OUTLIER Glycine 0 C--O 1.224 -0.47 0 O-C-N 120.691 -1.476 . . . . 0.0 112.299 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 53.3 m -134.75 160.95 36.57 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 117.012 0.406 . . . . 0.0 111.545 170.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.8 m -54.68 -37.61 65.98 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.121 0.969 . . . . 0.0 112.966 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -135.44 -56.34 0.79 Allowed 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.279 1.432 . . . . 0.0 110.382 -179.474 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.518 HG21 ' HG2' ' A' ' 21' ' ' ARG . 2.4 p -152.76 145.49 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.992 0.917 . . . . 0.0 111.898 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 61.2 m -86.2 134.33 33.79 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.091 172.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.62 146.59 29.48 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.108 0.963 . . . . 0.0 110.962 172.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -86.21 107.35 17.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.723 0.809 . . . . 0.0 112.05 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.34 -29.56 70.54 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.469 -0.77 . . . . 0.0 111.704 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.4 m . . . . . 0 N--CA 1.47 0.534 0 O-C-N 119.818 -1.801 . . . . 0.0 113.087 176.246 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.532 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.18 65.92 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-N 118.261 0.482 . . . . 0.0 113.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -88.75 12.27 15.41 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.015 1.726 . . . . 0.0 113.52 173.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.47 40.47 9.92 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.691 1.139 . . . . 0.0 112.411 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.14 165.02 31.33 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 121.566 0.537 . . . . 0.0 113.578 174.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -146.93 154.61 41.48 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.912 1.285 . . . . 0.0 112.081 -176.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.0 t -73.28 127.14 31.79 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.716 -1.24 . . . . 0.0 110.604 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -126.33 149.93 68.66 Favored Pre-proline 0 CA--C 1.543 0.695 0 C-N-CA 123.607 0.763 . . . . 0.0 111.074 -178.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.28 158.91 55.51 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.524 2.15 . . . . 0.0 111.744 176.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.421 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 16.0 mt -61.71 -19.79 62.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.525 0.73 . . . . 0.0 112.935 176.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -80.99 -15.41 56.29 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.004 2.122 . . . . 0.0 112.618 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -87.12 137.33 32.44 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 120.962 -1.087 . . . . 0.0 109.718 174.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.6 120.41 28.89 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.793 1.237 . . . . 0.0 111.075 172.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.13 -177.91 5.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.003 0.921 . . . . 0.0 110.361 174.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.62 112.51 22.39 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.357 -0.839 . . . . 0.0 110.404 170.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.28 133.03 50.21 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.308 1.443 . . . . 0.0 113.02 177.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mt -87.52 154.77 20.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 120.435 -1.416 . . . . 0.0 110.265 177.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -68.3 -36.79 79.87 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.92 -37.56 67.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.062 0.545 . . . . 0.0 110.993 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -75.99 -30.5 58.58 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.1 t -49.08 -44.77 42.29 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.273 0.629 . . . . 0.0 112.179 171.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.62 -38.75 72.51 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.511 -0.757 . . . . 0.0 112.978 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.6 t -51.11 -44.75 61.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.527 1.531 . . . . 0.0 112.725 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.8 m -68.4 -60.29 2.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.409 0.684 . . . . 0.0 112.152 172.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 136.55 -156.73 23.26 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 122.387 0.993 . . . . 0.0 113.816 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -80.88 133.14 35.52 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.762 -1.434 . . . . 0.0 111.574 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.24 10.0 84.29 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 123.916 0.77 . . . . 0.0 114.381 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -137.56 155.14 49.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.013 1.325 . . . . 0.0 109.948 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 19.3 mmtp -136.26 131.04 33.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.503 1.921 . . . . 0.0 109.437 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.4 t -73.56 111.04 8.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.404 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 40.5 m -106.21 161.29 14.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.557 0.694 . . . . 0.0 111.724 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p -129.59 144.16 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 123.556 0.743 . . . . 0.0 111.121 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.4 m95 . . . . . 0 C--O 1.235 0.315 0 CA-C-O 122.484 1.135 . . . . 0.0 111.008 174.901 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 . . . . . 0 N--CA 1.471 0.595 0 CA-C-O 120.809 0.338 . . . . 0.0 111.34 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.634 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 87.4 m -50.83 -51.26 52.85 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.093 -1.004 . . . . 0.0 111.109 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -59.33 -32.35 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.202 1.001 . . . . 0.0 113.302 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.4 t -67.04 -29.07 68.77 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.66 1.584 . . . . 0.0 111.309 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.434 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 35.1 mmtt -94.31 -5.59 46.32 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 172.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.08 37.22 25.74 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-O 118.293 -1.282 . . . . 0.0 112.947 -177.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.43 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 43.1 m-85 -98.87 161.53 13.58 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.636 1.975 . . . . 0.0 112.216 174.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.72 130.49 9.12 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.303 0.954 . . . . 0.0 111.528 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.3 134.2 48.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 118.105 -0.95 . . . . 0.0 111.939 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.2 mt -145.39 156.15 53.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 O-C-N 123.741 0.651 . . . . 0.0 110.986 175.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -66.81 140.08 54.34 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.377 2.052 . . . . 0.0 110.4 174.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -49.4 -23.58 1.57 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 174.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 p -70.78 -44.48 66.57 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.651 1.18 . . . . 0.0 112.698 173.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -79.67 -42.22 25.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.923 1.689 . . . . 0.0 111.766 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.5 t -89.73 122.22 68.28 Favored Pre-proline 0 C--O 1.245 0.865 0 C-N-CA 124.525 1.13 . . . . 0.0 111.847 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.18 146.73 94.27 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.866 2.377 . . . . 0.0 110.85 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -51.39 -29.08 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -70.2 -24.65 63.16 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.67 -17.53 17.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.446 1.899 . . . . 0.0 113.984 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.506 ' HG2' HG21 ' A' ' 30' ' ' VAL . 85.4 mtt180 -57.11 101.33 0.06 Allowed 'General case' 0 N--CA 1.463 0.186 0 O-C-N 121.307 -0.871 . . . . 0.0 111.113 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 33' ' ' ASP . 53.8 mt -85.21 168.12 15.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 122.406 1.098 . . . . 0.0 110.815 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -120.59 30.6 6.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.428 1.891 . . . . 0.0 112.403 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.634 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 38.6 m-85 -67.46 -16.48 64.24 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 121.535 -0.728 . . . . 0.0 112.667 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.07 67.07 2.14 Favored Glycine 0 N--CA 1.469 0.897 0 CA-C-N 119.825 1.193 . . . . 0.0 112.831 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -164.34 25.24 0.18 Allowed Glycine 0 N--CA 1.462 0.426 0 O-C-N 120.983 -1.304 . . . . 0.0 114.276 -177.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 55.4 m -132.39 151.03 52.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.866 0.866 . . . . 0.0 111.541 175.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.9 m -53.36 -41.82 66.21 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.191 0.997 . . . . 0.0 112.941 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.0 -72.64 0.68 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.993 1.717 . . . . 0.0 109.581 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.506 HG21 ' HG2' ' A' ' 21' ' ' ARG . 3.3 p -143.97 140.62 25.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.413 1.085 . . . . 0.0 111.227 -177.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 97.4 m -79.8 137.89 37.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.043 -1.036 . . . . 0.0 109.477 172.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.67 133.22 53.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.349 1.06 . . . . 0.0 111.766 172.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.658 ' HB3' HD11 ' A' ' 22' ' ' LEU . 1.1 p30 -80.27 97.22 6.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 123.436 1.589 . . . . 0.0 113.937 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 mt -59.24 -41.26 88.29 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 119.785 -1.822 . . . . 0.0 110.955 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.511 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.229 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.74 -27.98 69.24 Favored Glycine 0 CA--C 1.534 1.245 0 CA-C-O 119.358 -0.69 . . . . 0.0 112.978 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -86.27 13.25 8.32 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.391 2.276 . . . . 0.0 113.318 173.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.34 37.16 54.53 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-N 118.252 0.478 . . . . 0.0 113.055 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.14 162.18 13.19 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 125.639 1.59 . . . . 0.0 113.466 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -142.95 150.12 39.29 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 124.756 1.222 . . . . 0.0 109.894 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 96.5 m -61.89 114.46 3.37 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.388 -0.82 . . . . 0.0 111.8 174.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -116.14 148.23 41.06 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.521 1.128 . . . . 0.0 111.015 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.48 152.26 78.85 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.774 2.316 . . . . 0.0 111.186 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.5 mt -60.75 -20.92 62.38 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.98 -20.26 59.74 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.528 1.531 . . . . 0.0 112.468 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -86.03 128.17 34.81 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 120.781 -1.199 . . . . 0.0 109.959 176.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.82 118.87 23.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.493 0.717 . . . . 0.0 110.926 174.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.19 173.86 11.89 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.516 1.126 . . . . 0.0 110.354 176.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.3 ttmt -82.33 114.32 20.72 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.84 129.77 51.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.608 1.563 . . . . 0.0 112.316 177.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 21.9 tp -85.47 136.08 33.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 120.642 -1.286 . . . . 0.0 110.067 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -54.12 -38.1 65.06 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.695 -1.253 . . . . 0.0 113.982 172.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.48 -33.53 74.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.025 0.93 . . . . 0.0 110.546 177.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -79.32 -33.02 43.51 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.232 1.013 . . . . 0.0 112.206 178.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.41 ' CB ' ' HD3' ' A' ' 69' ' ' LYS . 24.7 p -55.07 -28.86 55.54 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.224 1.01 . . . . 0.0 113.477 176.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.84 -35.26 77.73 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.404 1.082 . . . . 0.0 112.851 174.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.8 t -56.48 -45.54 80.88 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.877 1.271 . . . . 0.0 112.179 178.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 66.6 m -74.91 -43.11 56.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.299 0.64 . . . . 0.0 112.512 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 114.93 -146.75 18.86 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 122.414 1.008 . . . . 0.0 112.586 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -87.62 147.04 25.46 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.116 -1.226 . . . . 0.0 111.947 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.87 6.92 74.25 Favored Glycine 0 CA--C 1.538 1.51 0 N-CA-C 114.272 0.469 . . . . 0.0 114.272 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -138.51 153.45 48.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.486 1.514 . . . . 0.0 109.754 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.41 ' HD3' ' CB ' ' A' ' 61' ' ' SER . 14.8 mmtp -134.14 125.49 28.02 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 126.252 1.821 . . . . 0.0 110.179 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.56 107.81 7.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 118.988 -0.529 . . . . 0.0 110.584 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 24.9 m -98.4 157.5 16.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 123.147 0.579 . . . . 0.0 111.94 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.1 t -106.0 138.08 33.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 110.9 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.6 m95 . . . . . 0 N--CA 1.467 0.378 0 N-CA-C 114.881 1.438 . . . . 0.0 114.881 176.427 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 . . . . . 0 N--CA 1.471 0.601 0 CA-C-O 121.436 0.636 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -54.82 -58.77 6.23 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.303 -0.873 . . . . 0.0 111.348 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.2 p -58.01 -33.46 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 m -63.12 -28.57 70.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.217 1.007 . . . . 0.0 111.077 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.4 mmmp? -96.57 -10.59 26.89 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 173.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.52 36.73 7.86 Favored Glycine 0 CA--C 1.52 0.404 0 CA-C-O 118.488 -1.173 . . . . 0.0 112.097 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -97.41 165.44 12.01 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.763 1.282 . . . . 0.0 111.786 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.86 131.69 10.09 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 111.273 -0.731 . . . . 0.0 111.273 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.8 m -79.4 123.74 27.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 O-C-N 122.085 -0.656 . . . . 0.0 110.791 176.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.474 ' O ' HG12 ' A' ' 30' ' ' VAL . 31.9 mt -138.62 155.01 73.7 Favored Pre-proline 0 C--O 1.218 -0.602 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.725 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -63.77 139.79 70.7 Favored 'Trans proline' 0 C--O 1.219 -0.44 0 C-N-CA 124.333 3.355 . . . . 0.0 110.488 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.443 ' HA ' HG11 ' A' ' 30' ' ' VAL . 28.3 mp0 -51.62 -26.98 9.95 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 176.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 m -65.57 -46.81 78.05 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.893 0.877 . . . . 0.0 113.155 170.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -75.97 -36.59 59.2 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.509 0.723 . . . . 0.0 112.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.4 t -89.24 121.37 69.52 Favored Pre-proline 0 C--O 1.241 0.632 0 O-C-N 121.089 -1.007 . . . . 0.0 111.823 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -62.96 146.96 95.03 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.651 2.234 . . . . 0.0 110.545 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -52.05 -19.72 2.04 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.91 -32.54 27.21 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.637 1.175 . . . . 0.0 113.052 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.81 -20.58 25.89 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.078 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HD3' HG21 ' A' ' 30' ' ' VAL . 60.0 mtt180 -55.24 119.27 5.28 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.429 0.692 . . . . 0.0 110.078 175.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.0 mt -102.71 175.92 5.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.791 0.805 . . . . 0.0 110.272 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.3 29.85 7.55 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.26 1.024 . . . . 0.0 111.593 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -67.93 -18.36 64.74 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 121.341 -0.849 . . . . 0.0 111.914 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.89 49.97 67.26 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 120.734 -1.229 . . . . 0.0 112.441 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -142.7 33.65 1.85 Allowed Glycine 0 C--O 1.225 -0.458 0 CA-C-O 118.032 -1.427 . . . . 0.0 113.5 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -142.44 150.54 40.72 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.107 0.963 . . . . 0.0 111.777 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.1 m -58.67 -45.56 89.12 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 123.765 0.666 . . . . 0.0 111.416 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 58.4 p -105.66 -75.79 0.62 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.222 0.609 . . . . 0.0 109.594 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.572 HG21 ' HD3' ' A' ' 21' ' ' ARG . 7.7 p -148.16 148.0 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 126.014 1.726 . . . . 0.0 110.49 179.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.85 131.34 35.85 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.127 -0.983 . . . . 0.0 110.891 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.22 139.11 45.73 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.384 1.074 . . . . 0.0 111.737 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -81.09 101.2 9.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.808 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.47 -19.42 64.72 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.246 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 N--CA 1.472 0.65 0 CA-C-N 120.105 1.32 . . . . 0.0 112.336 176.081 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt . . . . . 0 C--O 1.221 -0.43 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.1 -39.3 63.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.889 0.757 . . . . 0.0 113.083 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.0 mttm -79.31 11.92 2.66 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.444 1.098 . . . . 0.0 113.487 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.8 39.43 96.76 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.171 0.891 . . . . 0.0 112.292 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.69 172.17 46.07 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 121.954 0.752 . . . . 0.0 112.376 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -136.16 150.1 48.91 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 123.012 1.386 . . . . 0.0 112.434 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.5 t -79.17 135.69 36.88 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 120.753 -1.217 . . . . 0.0 111.662 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -133.28 148.06 67.51 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 124.061 0.944 . . . . 0.0 111.23 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.94 159.13 54.29 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.657 2.238 . . . . 0.0 110.896 177.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.421 HD11 ' HA2' ' A' ' 67' ' ' GLY . 28.7 mt -61.92 -16.73 53.08 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 175.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -84.61 -13.51 51.42 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 123.617 1.675 . . . . 0.0 111.963 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -92.83 130.59 38.39 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 118.783 -2.448 . . . . 0.0 110.246 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -85.12 121.55 28.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.333 176.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.496 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 1.8 t -162.1 176.44 10.69 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.903 0.881 . . . . 0.0 110.688 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.3 ttmt -94.87 108.25 20.28 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.04 0.936 . . . . 0.0 111.611 175.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.83 132.04 53.38 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.766 1.226 . . . . 0.0 111.094 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 58' ' ' GLN . 15.6 tp -77.69 137.7 38.65 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.009 -1.057 . . . . 0.0 109.593 176.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.439 ' N ' HD12 ' A' ' 57' ' ' LEU . 5.9 pt20 -53.34 -40.15 64.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.754 -1.216 . . . . 0.0 113.521 173.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.66 -24.19 63.58 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.878 0.871 . . . . 0.0 111.828 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -88.98 -31.06 18.31 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.467 1.107 . . . . 0.0 112.596 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 51.6 p -53.83 -28.04 33.28 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.828 1.251 . . . . 0.0 112.024 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.46 74.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.391 1.076 . . . . 0.0 112.332 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 m -56.93 -56.94 15.18 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.862 1.265 . . . . 0.0 111.307 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.33 -43.78 96.1 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.02 171.74 19.49 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 122.917 1.287 . . . . 0.0 112.271 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -56.58 135.41 54.71 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.464 -1.021 . . . . 0.0 110.764 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.421 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 86.28 9.87 75.45 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.852 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -144.56 169.05 18.71 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 110.795 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -131.77 156.62 45.66 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.558 1.543 . . . . 0.0 110.878 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.9 t -121.3 95.23 4.6 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.218 0.607 . . . . 0.0 111.545 -178.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.1 t -83.65 162.95 20.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -115.34 144.66 22.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 124.621 1.168 . . . . 0.0 111.213 174.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.496 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 33.3 m95 . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 122.28 1.038 . . . . 0.0 112.586 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 . . . . . 0 N--CA 1.476 0.834 0 CA-C-O 122.064 0.935 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 61.5 m -57.38 -55.27 36.93 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 120.546 -1.346 . . . . 0.0 110.83 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -59.31 -29.65 42.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 122.606 0.363 . . . . 0.0 111.913 177.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -70.44 -27.88 64.59 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.687 0.795 . . . . 0.0 111.119 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.499 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 22.4 mmmt -95.5 -3.64 46.32 Favored 'General case' 0 C--N 1.338 0.106 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.7 42.25 11.64 Favored Glycine 0 C--O 1.225 -0.463 0 O-C-N 124.348 1.03 . . . . 0.0 111.323 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.496 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 38.3 m-85 -106.36 162.31 13.8 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 124.254 1.021 . . . . 0.0 111.581 176.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.49 140.68 16.21 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.879 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.9 m -79.97 117.11 20.52 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 122.885 0.474 . . . . 0.0 111.398 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.502 ' O ' HG12 ' A' ' 30' ' ' VAL . 53.2 mt -132.35 154.43 81.59 Favored Pre-proline 0 C--O 1.214 -0.791 0 O-C-N 123.576 0.547 . . . . 0.0 111.722 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -64.54 140.96 71.44 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 123.794 2.996 . . . . 0.0 110.622 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.525 ' HA ' HG11 ' A' ' 30' ' ' VAL . 65.3 mt-30 -51.2 -25.48 5.53 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 177.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 91.3 p -68.8 -46.91 67.43 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 171.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.439 ' OD2' HD22 ' A' ' 11' ' ' LEU . 28.5 t0 -72.64 -34.51 67.34 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.886 0.874 . . . . 0.0 111.911 176.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.6 t -92.84 126.65 50.82 Favored Pre-proline 0 CA--C 1.539 0.55 0 O-C-N 120.884 -1.135 . . . . 0.0 111.917 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -63.82 147.36 92.32 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.609 2.206 . . . . 0.0 110.671 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -19.53 3.71 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 172.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -81.73 -31.82 31.85 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 123.893 0.877 . . . . 0.0 112.197 175.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.89 -24.62 23.59 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -45.97 117.56 1.56 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.619 0.768 . . . . 0.0 110.376 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.4 HD11 ' HB3' ' A' ' 33' ' ' ASP . 51.7 mt -103.22 174.61 5.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.337 1.065 . . . . 0.0 109.995 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -128.1 31.46 5.07 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.732 0.813 . . . . 0.0 111.177 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.509 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 33.0 m-85 -69.0 -17.53 63.93 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 121.226 -0.921 . . . . 0.0 112.065 177.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.36 88.03 0.05 OUTLIER Glycine 0 CA--C 1.532 1.104 0 CA-C-O 124.51 2.172 . . . . 0.0 111.857 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.24 25.97 0.03 OUTLIER Glycine 0 C--O 1.224 -0.506 0 O-C-N 119.909 -1.936 . . . . 0.0 113.652 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 67.7 m -137.24 149.79 47.4 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 123.415 0.686 . . . . 0.0 111.454 177.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -61.86 -42.6 99.24 Favored 'General case' 0 C--O 1.222 -0.371 0 O-C-N 124.364 1.04 . . . . 0.0 111.291 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.5 p -107.67 -75.19 0.64 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.395 0.678 . . . . 0.0 110.245 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.525 HG11 ' HA ' ' A' ' 13' ' ' GLN . 8.4 p -151.05 143.6 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.919 1.343 . . . . 0.0 111.06 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 91.9 m -82.0 124.17 29.55 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.279 -1.513 . . . . 0.0 110.259 173.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.89 142.99 33.44 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 122.315 1.055 . . . . 0.0 111.407 174.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.468 ' HA ' ' CD1' ' A' ' 8' ' ' PHE . 1.9 p30 -81.03 100.71 9.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 124.247 1.975 . . . . 0.0 113.731 177.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.435 HD22 ' CD ' ' A' ' 41' ' ' LYS . 8.8 mt -65.89 -27.84 68.5 Favored 'General case' 0 C--O 1.218 -0.557 0 O-C-N 118.733 -2.479 . . . . 0.0 111.723 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.1 t . . . . . 0 N--CA 1.466 0.348 0 C-N-CA 124.3 1.04 . . . . 0.0 112.888 177.149 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.435 ' CD ' HD22 ' A' ' 34' ' ' LEU . 74.3 mttt . . . . . 0 C--O 1.222 -0.349 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.41 -34.22 33.71 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.524 0.583 . . . . 0.0 113.958 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.6 mmtt -85.68 15.28 4.82 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.198 1.399 . . . . 0.0 113.024 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.72 36.89 93.93 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 123.735 0.683 . . . . 0.0 112.243 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.82 177.49 21.88 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 121.876 0.709 . . . . 0.0 112.192 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -142.28 152.77 43.33 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.7 1.238 . . . . 0.0 111.819 178.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.9 t -66.49 128.77 37.5 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 111.948 175.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -125.23 148.0 59.23 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 122.284 1.04 . . . . 0.0 111.793 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.04 156.23 65.86 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.287 1.992 . . . . 0.0 111.147 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.44 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 9.7 mt -65.16 -18.07 65.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 176.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -85.4 -9.6 57.33 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.402 0.681 . . . . 0.0 112.09 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -93.36 131.21 38.73 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 120.871 -1.143 . . . . 0.0 110.052 176.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -78.8 121.71 25.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.27 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.4 t -168.34 174.56 6.93 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 123.916 0.886 . . . . 0.0 110.055 176.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -92.51 124.45 36.55 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.458 1.103 . . . . 0.0 111.127 173.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -125.91 131.8 52.25 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 125.686 1.594 . . . . 0.0 110.687 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 58' ' ' GLN . 12.3 tp -91.21 135.22 33.94 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.562 -0.711 . . . . 0.0 109.808 177.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.439 ' N ' HD12 ' A' ' 57' ' ' LEU . 7.0 pt20 -51.0 -40.25 57.7 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 175.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.01 64.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.142 0.977 . . . . 0.0 111.863 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.402 ' OE1' HD23 ' A' ' 57' ' ' LEU . 1.3 mp0 -95.93 -33.53 12.15 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.67 1.188 . . . . 0.0 110.428 -178.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.1 m -53.53 -30.6 42.46 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.185 0.994 . . . . 0.0 111.37 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.87 63.42 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.82 0.848 . . . . 0.0 112.937 174.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.5 t -58.01 -58.05 10.11 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.705 0.802 . . . . 0.0 111.378 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 97.9 m -71.69 -47.25 55.42 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.964 0.412 . . . . 0.0 111.559 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -150.51 18.51 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-O 123.36 1.533 . . . . 0.0 112.38 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -78.29 145.52 35.33 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 120.249 -1.736 . . . . 0.0 111.354 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.71 0.63 85.16 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 119.31 -0.717 . . . . 0.0 113.544 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -149.21 149.31 30.77 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.219 1.007 . . . . 0.0 110.713 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.44 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -132.09 138.86 48.3 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.472 0.709 . . . . 0.0 110.29 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.5 t -77.59 131.45 37.83 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.877 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.515 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.1 OUTLIER -120.25 150.62 40.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 119.676 1.125 . . . . 0.0 110.386 177.333 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.41 141.31 46.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 123.555 0.742 . . . . 0.0 110.308 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.515 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 11.7 m95 . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 122.023 0.916 . . . . 0.0 111.975 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 . . . . . 0 N--CA 1.468 0.433 0 CA-C-O 120.473 0.178 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.7 m -51.97 -55.97 17.12 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 121.136 -0.977 . . . . 0.0 111.136 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.6 p -56.93 -34.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 175.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.0 t -63.02 -27.17 69.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.068 1.347 . . . . 0.0 112.409 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.407 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 1.0 OUTLIER -96.74 -9.7 28.39 Favored 'General case' 0 C--N 1.34 0.176 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 171.299 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 85.89 29.66 25.49 Favored Glycine 0 CA--C 1.525 0.668 0 CA-C-O 117.826 -1.541 . . . . 0.0 112.989 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.407 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 66.5 m-85 -88.81 168.88 12.09 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.065 1.433 . . . . 0.0 113.194 175.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.42 129.79 8.64 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.494 1.045 . . . . 0.0 111.623 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.2 m -77.16 132.4 38.78 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.053 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.3 mt -142.59 162.68 43.2 Favored Pre-proline 0 N--CA 1.469 0.513 0 O-C-N 124.327 1.017 . . . . 0.0 111.152 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -70.48 140.92 41.06 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.536 2.157 . . . . 0.0 111.127 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -55.4 -20.86 13.39 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.1 t -67.63 -48.47 66.64 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.902 1.281 . . . . 0.0 113.444 169.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -73.58 -44.68 56.7 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-O 123.173 1.463 . . . . 0.0 112.18 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.8 t -79.34 116.63 61.94 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 119.851 -1.78 . . . . 0.0 112.874 -178.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.67 154.12 71.08 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.012 1.808 . . . . 0.0 111.918 -177.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -28.4 22.22 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -81.68 -18.96 42.67 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.624 1.97 . . . . 0.0 113.114 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.71 -21.72 17.42 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 116.206 -1.854 . . . . 0.0 113.098 172.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -54.91 111.78 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.192 1.36 . . . . 0.0 111.335 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.589 HD21 ' HB2' ' A' ' 33' ' ' ASP . 2.6 mt -94.8 174.61 7.02 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.713 0.768 . . . . 0.0 109.921 -178.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.2 m -118.24 25.49 10.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.921 1.288 . . . . 0.0 112.675 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -66.03 -20.81 66.3 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-O 117.701 -1.143 . . . . 0.0 112.151 174.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.9 73.25 0.45 Allowed Glycine 0 N--CA 1.476 1.308 0 CA-C-N 121.107 1.776 . . . . 0.0 112.667 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -177.38 29.02 0.07 OUTLIER Glycine 0 C--O 1.23 -0.132 0 O-C-N 120.674 -1.486 . . . . 0.0 113.266 -174.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.6 m -129.58 157.75 41.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.631 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.0 t -44.19 -47.28 9.17 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.067 1.479 . . . . 0.0 112.664 -177.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -131.49 -59.3 0.97 Allowed 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.322 1.449 . . . . 0.0 110.21 177.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.4 p -140.33 153.3 21.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 122.676 1.227 . . . . 0.0 110.919 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.414 ' SG ' HD12 ' A' ' 22' ' ' LEU . 2.4 t -93.78 137.02 33.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.101 174.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -113.17 140.09 48.21 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 122.509 1.147 . . . . 0.0 112.523 176.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.589 ' HB2' HD21 ' A' ' 22' ' ' LEU . 11.8 t0 -81.09 101.25 9.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.79 -1.095 . . . . 0.0 111.523 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -62.64 -37.92 88.24 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.644 -1.17 . . . . 0.0 112.127 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.474 0.767 0 C-N-CA 125.361 1.464 . . . . 0.0 112.414 178.138 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt . . . . . 0 C--O 1.225 -0.191 0 CA-C-O 118.058 -0.972 . . . . 0.0 112.76 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.35 54.84 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.98 1.276 . . . . 0.0 114.216 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -81.78 12.29 4.11 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.766 1.626 . . . . 0.0 114.28 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.5 22.26 76.44 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.785 1.183 . . . . 0.0 114.49 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.96 -175.81 30.63 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.506 1.051 . . . . 0.0 112.626 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.13 149.65 29.73 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.227 1.011 . . . . 0.0 111.504 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.29 130.59 47.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 120.998 -1.064 . . . . 0.0 112.442 172.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -128.46 151.89 77.41 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.75 0.82 . . . . 0.0 111.435 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.03 153.63 67.47 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.506 2.137 . . . . 0.0 110.616 176.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.98 -20.46 62.44 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -73.93 -18.92 60.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.511 1.524 . . . . 0.0 113.399 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -86.72 129.57 34.82 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 120.512 -1.367 . . . . 0.0 109.834 174.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -79.64 125.37 29.53 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.94 170.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.36 174.15 3.96 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.4 1.08 . . . . 0.0 110.703 175.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -86.54 124.26 32.64 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.208 1.003 . . . . 0.0 110.451 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -124.33 139.03 54.29 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.097 1.498 . . . . 0.0 112.09 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.89 148.98 22.83 Favored 'General case' 0 C--O 1.22 -0.485 0 O-C-N 120.801 -1.187 . . . . 0.0 109.645 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -64.15 -40.05 95.32 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.399 -0.813 . . . . 0.0 112.369 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.79 -32.55 59.93 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.61 -36.73 28.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.612 -0.68 . . . . 0.0 112.72 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.2 m -54.38 -29.42 48.57 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.116 1.367 . . . . 0.0 112.26 175.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.14 86.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 117.963 -1.018 . . . . 0.0 112.94 174.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t -44.13 -58.04 3.07 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.791 2.037 . . . . 0.0 112.074 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -80.36 -56.2 4.36 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.878 172.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 42.57 -147.54 0.64 Allowed Glycine 0 C--N 1.35 1.326 0 C-N-CA 127.247 2.356 . . . . 0.0 112.353 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt 49.09 46.47 22.61 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 119.837 1.819 . . . . 0.0 114.277 174.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.77 23.0 62.91 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 121.266 -0.896 . . . . 0.0 114.201 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -132.24 159.47 38.96 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 126.379 1.872 . . . . 0.0 110.086 177.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -137.98 124.33 20.6 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 126.439 1.895 . . . . 0.0 109.835 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.53 125.94 28.24 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.517 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.1 m -120.08 137.79 53.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 120.055 1.298 . . . . 0.0 111.798 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.1 p -106.79 144.52 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 122.12 0.962 . . . . 0.0 110.395 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.6 m95 . . . . . 0 CA--C 1.539 0.536 0 C-N-CA 124.82 1.248 . . . . 0.0 111.956 172.142 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 . . . . . 0 N--CA 1.47 0.575 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.2 m -47.86 -54.95 10.94 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.07 -1.019 . . . . 0.0 111.863 173.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 p -57.41 -34.09 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.065 1.346 . . . . 0.0 112.795 176.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 t -64.5 -29.48 70.52 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.33 1.452 . . . . 0.0 111.73 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.411 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 24.5 mmmt -94.37 -3.55 50.12 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 172.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 78.01 35.26 35.31 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-N 118.797 0.726 . . . . 0.0 113.073 -176.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.483 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 39.0 m-85 -99.19 166.3 11.3 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.949 1.3 . . . . 0.0 112.466 173.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 143.62 17.53 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.255 0.931 . . . . 0.0 111.308 179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.82 131.38 35.26 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.724 -0.868 . . . . 0.0 110.861 174.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -141.51 156.84 66.61 Favored Pre-proline 0 N--CA 1.471 0.589 0 C-N-CA 123.536 0.734 . . . . 0.0 111.144 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.69 139.28 62.61 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.731 2.287 . . . . 0.0 110.727 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -53.28 -18.84 2.68 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 175.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -71.31 -47.11 58.7 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.415 1.886 . . . . 0.0 111.902 170.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.69 -36.07 44.16 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.573 1.149 . . . . 0.0 111.993 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.7 t -88.17 112.03 46.86 Favored Pre-proline 0 C--O 1.246 0.869 0 C-N-CA 123.878 0.871 . . . . 0.0 111.668 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.91 153.96 64.79 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 123.033 2.489 . . . . 0.0 110.937 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -50.47 -35.07 27.34 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.026 -1.046 . . . . 0.0 113.798 175.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -71.1 -20.76 62.3 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.341 1.056 . . . . 0.0 113.378 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.85 -19.21 16.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.372 1.869 . . . . 0.0 114.656 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HD3' HG21 ' A' ' 30' ' ' VAL . 71.6 mtt180 -61.17 115.54 3.87 Favored 'General case' 0 CA--C 1.522 -0.104 0 O-C-N 121.25 -0.906 . . . . 0.0 109.982 173.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.638 HD11 ' HB3' ' A' ' 33' ' ' ASP . 11.9 mt -100.64 166.78 10.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.721 0.772 . . . . 0.0 110.846 178.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.32 27.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.811 1.244 . . . . 0.0 112.573 177.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.489 ' CE2' HD13 ' A' ' 22' ' ' LEU . 68.1 m-85 -65.46 -22.47 66.75 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.117 -0.989 . . . . 0.0 112.666 175.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.61 76.95 0.2 Allowed Glycine 0 CA--C 1.532 1.096 0 CA-C-N 120.025 1.284 . . . . 0.0 113.696 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -175.25 31.63 0.09 OUTLIER Glycine 0 N--CA 1.464 0.501 0 O-C-N 121.141 -1.211 . . . . 0.0 113.324 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.7 m -136.98 148.24 46.79 Favored 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 124.198 0.999 . . . . 0.0 111.272 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.9 m -58.65 -41.92 87.16 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.799 0.84 . . . . 0.0 112.053 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 p -109.55 -75.19 0.63 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.401 1.08 . . . . 0.0 109.069 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' A' ' 21' ' ' ARG . 13.8 p -147.18 149.11 15.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 126.337 1.855 . . . . 0.0 109.687 177.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.9 t -76.98 128.13 33.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.636 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -114.36 131.45 56.55 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.403 1.081 . . . . 0.0 111.25 177.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.638 ' HB3' HD11 ' A' ' 22' ' ' LEU . 1.5 p30 -84.58 97.7 9.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 124.186 1.946 . . . . 0.0 113.219 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.469 HD22 ' HB3' ' A' ' 41' ' ' LYS . 16.0 mt -54.67 -35.53 63.63 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.161 178.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.1 m . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.583 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.469 ' HB3' HD22 ' A' ' 34' ' ' LEU . 54.1 mttt . . . . . 0 N--CA 1.466 0.352 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.28 -41.88 87.72 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.961 0.791 . . . . 0.0 113.765 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -83.92 16.55 2.77 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.644 1.578 . . . . 0.0 114.069 174.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.19 42.19 76.92 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.465 1.031 . . . . 0.0 114.499 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -123.08 175.06 16.56 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.043 1.782 . . . . 0.0 113.925 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -150.66 149.03 29.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.993 1.317 . . . . 0.0 111.048 -175.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -65.84 123.0 18.6 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.119 -0.988 . . . . 0.0 111.483 173.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -127.34 148.22 65.36 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 124.636 1.175 . . . . 0.0 111.22 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -68.02 157.07 63.4 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.458 2.105 . . . . 0.0 111.125 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -62.07 -21.89 65.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -75.22 -13.07 60.41 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.255 2.222 . . . . 0.0 113.008 173.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.51 126.76 35.41 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 119.749 -1.845 . . . . 0.0 110.269 174.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -78.29 117.6 19.7 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.798 0.839 . . . . 0.0 110.076 171.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.2 t -163.06 176.87 9.64 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.333 1.453 . . . . 0.0 109.553 171.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -91.42 106.85 18.79 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 125.505 1.522 . . . . 0.0 110.147 172.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -101.3 141.94 33.44 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.037 0.922 . . . . 0.0 111.196 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.483 HD23 ' HG2' ' A' ' 60' ' ' GLU . 16.7 tp -89.98 134.84 34.0 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.071 -1.018 . . . . 0.0 109.526 170.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 pm0 -48.85 -44.93 40.08 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.079 1.352 . . . . 0.0 112.381 172.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.35 -23.64 64.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.715 1.206 . . . . 0.0 112.752 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.483 ' HG2' HD23 ' A' ' 57' ' ' LEU . 38.2 mm-40 -90.4 -39.02 12.92 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.947 1.299 . . . . 0.0 112.935 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.1 p -54.21 -28.5 41.29 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.936 -1.103 . . . . 0.0 112.603 173.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.78 -36.42 69.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.462 1.505 . . . . 0.0 113.157 175.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.3 m -70.63 -48.52 54.58 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.603 1.161 . . . . 0.0 113.281 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 17.3 m -62.29 -40.03 94.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.14 -176.35 25.63 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 122.616 1.12 . . . . 0.0 112.859 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -63.95 143.24 58.01 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.988 -1.301 . . . . 0.0 111.571 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.06 10.62 85.98 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 119.133 -0.815 . . . . 0.0 114.385 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -137.15 160.59 38.55 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.624 1.57 . . . . 0.0 110.694 177.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -137.83 117.32 12.91 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.312 1.845 . . . . 0.0 110.543 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.0 t -74.73 97.59 3.27 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.815 -0.553 . . . . 0.0 110.967 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -77.31 161.67 27.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.605 1.562 . . . . 0.0 110.821 173.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.7 t -123.67 134.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.035 1.334 . . . . 0.0 109.745 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 24.0 m95 . . . . . 0 N--CA 1.463 0.221 0 C-N-CA 124.353 1.061 . . . . 0.0 112.065 178.405 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 . . . . . 0 C--O 1.22 -0.475 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.4 m -47.8 -55.92 8.58 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.658 -0.651 . . . . 0.0 111.284 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.5 p -58.91 -31.06 44.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.017 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.1 t -63.72 -30.12 71.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.727 0.811 . . . . 0.0 110.544 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.528 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 27.0 mmtt -96.18 -9.23 31.03 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.26 29.17 25.79 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 119.195 -0.78 . . . . 0.0 111.906 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.528 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 61.8 m-85 -89.75 168.74 11.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 118.331 1.065 . . . . 0.0 111.715 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.66 126.66 6.92 Favored Glycine 0 CA--C 1.519 0.306 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.546 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.0 m -75.78 139.43 41.8 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.95 -0.735 . . . . 0.0 111.076 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.5 mt -154.99 155.0 29.78 Favored Pre-proline 0 C--O 1.206 -1.202 0 O-C-N 124.19 0.931 . . . . 0.0 112.051 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.532 ' HA ' HG21 ' A' ' 29' ' ' THR . 51.0 Cg_endo -68.06 133.95 30.4 Favored 'Trans proline' 0 CA--C 1.506 -0.916 0 C-N-CA 123.98 3.12 . . . . 0.0 111.116 179.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.406 ' HG3' ' CG1' ' A' ' 30' ' ' VAL . 63.2 mt-30 -47.34 -27.83 1.77 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 123.191 0.596 . . . . 0.0 111.397 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.6 p -59.73 -47.43 85.7 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -83.12 -30.89 27.55 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.338 0.59 . . . . 0.0 112.46 177.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 20' ' ' ALA . 17.7 t -93.19 126.63 50.1 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 121.71 -0.619 . . . . 0.0 111.694 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.512 ' HG2' ' HB2' ' A' ' 20' ' ' ALA . 50.0 Cg_endo -67.49 153.01 77.81 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.855 2.37 . . . . 0.0 112.265 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -52.91 -35.08 57.72 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -73.23 -16.34 61.41 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 123.927 0.891 . . . . 0.0 111.13 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.512 ' HB2' ' HG2' ' A' ' 17' ' ' PRO . . . -95.29 -30.26 14.05 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 124.072 0.858 . . . . 0.0 113.052 177.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -54.27 113.01 1.1 Allowed 'General case' 0 C--N 1.334 -0.069 0 O-C-N 121.584 -0.698 . . . . 0.0 110.07 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.551 HD13 ' CE2' ' A' ' 24' ' ' TYR . 13.0 mt -96.33 177.92 5.54 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.776 0.798 . . . . 0.0 110.2 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.8 p -122.38 34.58 5.11 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.385 0.674 . . . . 0.0 111.391 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.551 ' CE2' HD13 ' A' ' 22' ' ' LEU . 59.1 m-85 -73.82 -16.87 61.13 Favored 'General case' 0 C--O 1.203 -1.379 0 O-C-N 122.092 -0.38 . . . . 0.0 110.84 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.6 80.99 0.07 OUTLIER Glycine 0 C--O 1.219 -0.839 0 CA-C-O 122.439 1.021 . . . . 0.0 111.905 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.2 26.07 0.04 OUTLIER Glycine 0 C--O 1.223 -0.538 0 O-C-N 120.796 -1.414 . . . . 0.0 112.795 -179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 56.2 m -124.44 156.98 36.27 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 117.02 0.41 . . . . 0.0 111.533 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -48.9 -44.73 40.43 Favored 'General case' 0 C--O 1.223 -0.338 0 O-C-N 123.923 0.765 . . . . 0.0 111.122 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.572 HG23 ' H ' ' A' ' 30' ' ' VAL . 1.2 t -132.34 -60.3 0.9 Allowed 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.601 0.76 . . . . 0.0 110.965 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.572 ' H ' HG23 ' A' ' 29' ' ' THR . 13.9 p -145.35 140.29 22.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 CA-C-O 121.847 0.832 . . . . 0.0 110.988 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 1.3 t -82.63 140.57 33.1 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.291 -0.88 . . . . 0.0 111.969 176.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -116.19 130.07 56.61 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.835 1.302 . . . . 0.0 110.742 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.16 106.39 7.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 123.128 1.442 . . . . 0.0 112.146 177.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mt -64.94 -37.7 88.53 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 119.271 -2.143 . . . . 0.0 110.182 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 m . . . . . 0 CA--C 1.528 0.123 0 O-C-N 121.803 -0.56 . . . . 0.0 112.05 178.844 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt . . . . . 0 C--O 1.222 -0.381 0 CA-C-O 121.516 0.674 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -69.42 -36.19 77.3 Favored Glycine 0 C--N 1.336 0.544 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.0 mttt -78.61 12.67 1.94 Allowed 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.58 42.08 14.63 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.788 -0.525 . . . . 0.0 111.788 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -115.65 169.39 12.91 Favored Glycine 0 CA--C 1.518 0.244 0 CA-C-N 117.033 0.417 . . . . 0.0 112.774 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -149.74 155.91 40.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.833 0.825 . . . . 0.0 112.127 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 t -73.71 130.8 40.73 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.102 -0.999 . . . . 0.0 112.456 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -135.76 148.44 65.35 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 121.598 0.713 . . . . 0.0 112.063 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.18 159.22 54.08 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.506 2.138 . . . . 0.0 111.508 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.464 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 14.4 mt -60.96 -15.84 35.92 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.55 -10.63 57.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.058 0.543 . . . . 0.0 111.455 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.46 129.15 41.34 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 121.775 0.798 . . . . 0.0 109.877 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -80.45 120.51 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.715 176.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -172.83 170.53 4.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.456 0.646 . . . . 0.0 111.169 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 tttt -83.08 111.13 18.6 Favored 'General case' 0 CA--C 1.522 -0.121 0 O-C-N 121.859 -0.525 . . . . 0.0 110.456 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -117.87 128.96 55.34 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.746 0.784 . . . . 0.0 111.293 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.607 HD12 ' HG3' ' A' ' 60' ' ' GLU . 15.7 mt -84.82 156.39 21.35 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.589 -0.694 . . . . 0.0 110.636 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -69.61 -33.95 73.39 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.351 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.47 -31.05 33.17 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 120.82 0.343 . . . . 0.0 111.813 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.607 ' HG3' HD12 ' A' ' 57' ' ' LEU . 8.7 mm-40 -80.45 -30.98 37.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.983 0.42 . . . . 0.0 111.007 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.406 ' HB2' ' HD3' ' A' ' 69' ' ' LYS . 93.6 p -55.31 -37.87 67.93 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.628 -0.67 . . . . 0.0 111.588 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.96 -36.69 72.92 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 123.525 0.516 . . . . 0.0 112.074 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 47.0 t -54.42 -54.37 41.69 Favored 'General case' 0 C--N 1.334 -0.108 0 O-C-N 123.411 0.444 . . . . 0.0 111.474 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 8.8 m -57.06 -49.97 74.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.377 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 116.21 175.6 17.92 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-O 122.496 1.053 . . . . 0.0 112.067 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -61.4 129.24 40.25 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.329 -1.101 . . . . 0.0 110.436 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.36 6.58 70.79 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 113.483 -179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -141.93 162.5 35.31 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.395 0.617 . . . . 0.0 110.951 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.464 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 64.5 mmtt -138.49 138.75 38.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 122.133 0.968 . . . . 0.0 111.93 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -84.49 106.04 15.76 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.583 -0.698 . . . . 0.0 110.672 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.33 156.17 21.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.674 0.75 . . . . 0.0 111.795 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.12 144.65 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 C-N-CA 123.226 0.61 . . . . 0.0 111.18 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 57.9 m95 . . . . . 0 C--N 1.326 -0.442 0 CA-C-O 121.541 0.686 . . . . 0.0 111.853 176.374 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.472 0.668 0 CA-C-O 120.582 0.229 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.2 m -53.67 -48.24 69.65 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.513 -1.367 . . . . 0.0 111.829 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -56.43 -27.1 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.552 1.141 . . . . 0.0 113.187 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 t -66.8 -35.19 79.49 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.875 1.27 . . . . 0.0 111.287 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.455 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 3.6 mmmm -96.9 -7.65 32.79 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 174.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.25 44.35 7.05 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.203 0.906 . . . . 0.0 112.396 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.455 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 35.6 m-85 -108.65 163.31 13.36 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.091 1.356 . . . . 0.0 112.169 176.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.77 145.29 18.4 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.276 0.941 . . . . 0.0 111.382 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.5 m -83.13 136.3 34.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.7 -0.883 . . . . 0.0 112.025 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.1 mt -148.6 155.83 41.8 Favored Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.738 0.815 . . . . 0.0 111.857 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.53 142.69 79.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.431 2.087 . . . . 0.0 110.884 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -52.54 -21.18 3.54 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 175.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 t -74.17 -46.96 38.92 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.102 1.761 . . . . 0.0 112.868 170.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -68.37 -50.27 54.28 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.276 1.03 . . . . 0.0 110.775 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.53 118.21 70.55 Favored Pre-proline 0 C--O 1.246 0.88 0 O-C-N 121.566 -0.709 . . . . 0.0 111.535 -174.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.02 151.06 86.67 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.793 2.329 . . . . 0.0 110.847 -177.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -52.33 -24.32 7.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -79.55 -28.73 41.21 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.367 1.467 . . . . 0.0 113.989 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -24.47 22.4 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.562 1.145 . . . . 0.0 111.206 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HG2' HG21 ' A' ' 30' ' ' VAL . 97.0 mtt180 -48.32 117.99 2.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.412 0.685 . . . . 0.0 110.885 174.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.436 HD21 ' HB2' ' A' ' 33' ' ' ASP . 19.5 mt -99.77 172.08 7.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.923 0.868 . . . . 0.0 110.455 179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.6 p -100.65 11.29 39.83 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.848 1.659 . . . . 0.0 112.985 177.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.418 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 54.4 m-85 -77.44 -11.74 59.88 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.133 -0.98 . . . . 0.0 112.2 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.72 -106.23 0.57 Allowed Glycine 0 C--O 1.216 -1.0 0 CA-C-O 116.771 -2.127 . . . . 0.0 110.176 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 39.48 28.04 0.1 Allowed Glycine 0 N--CA 1.474 1.21 0 C-N-CA 127.342 2.401 . . . . 0.0 115.419 175.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.0 m -145.67 146.71 31.4 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.441 1.496 . . . . 0.0 108.972 -169.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 m -68.66 -22.71 64.38 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 p -127.0 -75.86 0.58 Allowed 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 125.943 1.697 . . . . 0.0 110.659 -175.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.454 HG21 ' HG2' ' A' ' 21' ' ' ARG . 7.1 p -148.58 150.44 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 O-C-N 121.312 -0.868 . . . . 0.0 110.863 174.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 t -78.77 129.44 34.64 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 121.516 -0.74 . . . . 0.0 110.354 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -111.83 140.21 46.67 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.245 1.022 . . . . 0.0 112.964 177.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.436 ' HB2' HD21 ' A' ' 22' ' ' LEU . 14.4 t0 -88.98 104.31 16.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.262 1.029 . . . . 0.0 110.987 -178.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.508 HD22 ' HB3' ' A' ' 41' ' ' LYS . 53.7 mt -58.37 -33.11 69.21 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.022 175.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 125.122 1.369 . . . . 0.0 111.868 178.065 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.508 ' HB3' HD22 ' A' ' 34' ' ' LEU . 39.0 mmtt . . . . . 0 C--O 1.223 -0.291 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.194 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.99 -42.85 54.94 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 124.157 0.884 . . . . 0.0 113.601 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.568 ' HE3' ' OE1' ' A' ' 60' ' ' GLU . 7.6 mtmp? -78.99 15.44 1.11 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.033 1.733 . . . . 0.0 113.928 173.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.11 32.67 83.21 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.251 1.881 . . . . 0.0 114.42 -176.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -97.14 170.99 26.52 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-O 122.779 1.211 . . . . 0.0 113.417 177.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.2 tt0 -138.93 150.07 45.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.148 1.379 . . . . 0.0 111.756 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 90.5 m -71.87 120.25 17.2 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 120.754 -1.216 . . . . 0.0 111.192 173.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -110.52 150.69 42.02 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.307 1.043 . . . . 0.0 110.661 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.04 152.45 76.63 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.635 2.224 . . . . 0.0 111.543 176.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.663 HD11 ' HA2' ' A' ' 67' ' ' GLY . 39.6 mt -57.59 -24.52 56.77 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -73.76 -19.58 60.74 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.163 1.785 . . . . 0.0 112.862 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -89.18 134.82 33.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 123.08 1.419 . . . . 0.0 110.744 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -96.54 120.73 37.38 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 125.069 1.348 . . . . 0.0 109.439 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.6 p -166.76 170.67 12.19 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.174 1.39 . . . . 0.0 109.953 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -73.62 108.01 6.21 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.624 1.17 . . . . 0.0 109.863 175.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.91 145.58 42.05 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.075 0.95 . . . . 0.0 109.783 174.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.02 139.75 32.56 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.176 0.59 . . . . 0.0 110.326 173.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -63.14 -42.08 99.4 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.599 -0.688 . . . . 0.0 112.525 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.05 76.98 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.592 -0.692 . . . . 0.0 111.991 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.568 ' OE1' ' HE3' ' A' ' 43' ' ' LYS . 3.8 tp10 -85.7 -33.79 21.43 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.395 1.078 . . . . 0.0 113.482 -177.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.7 p -53.11 -34.2 55.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.693 1.597 . . . . 0.0 112.377 173.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.61 -36.18 71.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.38 1.072 . . . . 0.0 111.844 176.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -48.25 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.327 1.051 . . . . 0.0 112.473 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 67.6 m -60.84 -41.97 96.85 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 122.448 0.299 . . . . 0.0 111.693 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 113.37 174.24 18.89 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 122.679 1.155 . . . . 0.0 112.732 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -64.53 129.12 38.65 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.707 0.803 . . . . 0.0 109.76 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.663 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 88.36 13.99 62.69 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-O 117.871 -1.516 . . . . 0.0 113.42 -177.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -139.57 156.36 46.93 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.663 1.585 . . . . 0.0 110.639 176.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -127.04 119.0 25.55 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.253 1.821 . . . . 0.0 110.118 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.2 t -76.04 104.95 6.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.415 -0.803 . . . . 0.0 111.408 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 60.9 m -101.23 161.19 13.79 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.712 0.768 . . . . 0.0 112.058 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.8 m -116.22 145.07 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.604 0.762 . . . . 0.0 110.993 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 71.6 m95 . . . . . 0 N--CA 1.461 0.094 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.402 177.395 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 120.555 0.217 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 97.0 m -51.49 -63.18 1.22 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.275 1.03 . . . . 0.0 111.421 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.6 p -56.59 -34.81 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 112.773 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.5 t -62.64 -26.05 68.43 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.949 1.3 . . . . 0.0 112.422 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 6' ' ' LYS . 2.6 mmpt? -99.25 -7.18 26.79 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 171.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.38 28.74 35.33 Favored Glycine 0 CA--C 1.535 1.315 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.377 -175.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -90.54 160.84 15.76 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.672 1.736 . . . . 0.0 113.649 175.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.42 123.83 7.7 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 125.771 1.653 . . . . 0.0 111.797 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -73.85 131.11 41.16 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 121.333 -1.098 . . . . 0.0 111.283 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 70.6 mt -142.19 164.19 35.11 Favored Pre-proline 0 N--CA 1.472 0.649 0 C-N-CA 123.021 0.528 . . . . 0.0 110.583 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.42 141.49 35.19 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.161 1.907 . . . . 0.0 111.656 171.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -51.02 -15.57 0.33 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.864 1.666 . . . . 0.0 115.181 173.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 t -78.27 -39.54 39.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.953 2.101 . . . . 0.0 113.021 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -86.25 -37.1 18.95 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.69 1.596 . . . . 0.0 110.924 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.3 t -92.49 116.33 66.31 Favored Pre-proline 0 C--O 1.245 0.856 0 C-N-CA 124.431 1.092 . . . . 0.0 111.921 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.76 151.22 86.49 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.541 2.161 . . . . 0.0 111.672 -175.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -53.8 -28.71 36.75 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -72.89 -19.7 61.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.697 1.199 . . . . 0.0 113.658 176.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -102.65 -16.08 16.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 128.048 2.539 . . . . 0.0 114.276 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.519 ' HG2' HG21 ' A' ' 30' ' ' VAL . 89.5 mtt180 -59.74 105.25 0.36 Allowed 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.254 -0.903 . . . . 0.0 112.2 171.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.617 HD11 ' HB3' ' A' ' 33' ' ' ASP . 10.7 mt -93.6 163.32 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 111.846 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 p -103.71 22.39 14.5 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.11 1.764 . . . . 0.0 114.407 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.551 ' CE2' HD13 ' A' ' 22' ' ' LEU . 85.2 m-85 -67.79 3.51 1.44 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.964 1.706 . . . . 0.0 115.452 175.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 38.98 64.33 0.93 Allowed Glycine 0 N--CA 1.475 1.261 0 C-N-CA 126.917 2.199 . . . . 0.0 114.876 171.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -165.22 28.17 0.2 Allowed Glycine 0 C--O 1.226 -0.395 0 CA-C-O 118.738 -1.035 . . . . 0.0 113.472 -173.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.6 m -130.42 161.91 30.31 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.6 0.76 . . . . 0.0 112.422 177.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -53.54 -36.34 61.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.508 1.123 . . . . 0.0 113.549 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.29 -50.29 0.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.543 1.137 . . . . 0.0 111.074 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.519 HG21 ' HG2' ' A' ' 21' ' ' ARG . 11.9 p -147.24 149.29 15.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 122.07 0.938 . . . . 0.0 111.432 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.412 ' HB3' ' HB2' ' A' ' 22' ' ' LEU . 4.2 t -89.7 137.66 32.14 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 124.355 1.062 . . . . 0.0 108.8 172.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.16 133.18 56.27 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.105 0.962 . . . . 0.0 111.225 177.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.617 ' HB3' HD11 ' A' ' 22' ' ' LEU . 2.7 p30 -82.36 90.01 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 123.97 1.843 . . . . 0.0 112.679 -177.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -50.31 -33.66 20.91 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.123 1.156 . . . . 0.0 114.123 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 177.823 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.455 ' HE2' ' OE2' ' A' ' 46' ' ' GLU . 34.1 mmtp . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.91 -29.77 62.4 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.116 0.865 . . . . 0.0 115.011 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -87.51 8.22 25.92 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.14 32.78 30.93 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.341 0.972 . . . . 0.0 113.422 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.8 164.03 28.65 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 124.282 0.944 . . . . 0.0 113.332 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.455 ' OE2' ' HE2' ' A' ' 41' ' ' LYS . 8.6 tp10 -152.13 151.8 31.51 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.574 1.15 . . . . 0.0 112.539 178.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 36.4 m -70.19 121.46 17.6 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.874 -1.141 . . . . 0.0 111.369 174.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -121.89 148.25 50.72 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.977 0.911 . . . . 0.0 111.784 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -69.29 155.44 67.48 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.456 2.104 . . . . 0.0 110.697 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.7 mt -60.59 -21.31 62.49 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -74.17 -20.53 60.18 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 128.258 2.623 . . . . 0.0 112.86 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -88.62 119.89 29.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.298 -1.501 . . . . 0.0 110.638 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -63.04 117.67 6.78 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.136 0.574 . . . . 0.0 111.09 168.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.9 t -155.66 -173.1 4.39 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.305 1.042 . . . . 0.0 110.055 166.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -96.84 108.1 20.71 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.201 1.8 . . . . 0.0 110.098 167.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -107.87 147.67 30.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.66 120.36 42.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.402 1.481 . . . . 0.0 110.255 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.406 ' NE2' ' H ' ' A' ' 58' ' ' GLN . 5.7 mp0 -55.36 -34.79 64.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.609 0.764 . . . . 0.0 111.685 -176.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.77 -39.4 65.35 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.693 2.397 . . . . 0.0 113.956 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -105.85 -13.73 15.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.143 1.377 . . . . 0.0 112.386 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -55.83 -37.57 68.87 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.14 -1.6 . . . . 0.0 112.108 174.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.83 -32.0 71.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.54 1.536 . . . . 0.0 113.417 173.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -63.94 -48.96 74.48 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.268 1.427 . . . . 0.0 111.971 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.9 t -67.98 -29.93 69.08 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 175.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.73 176.62 25.89 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-O 122.865 1.258 . . . . 0.0 113.672 176.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -64.68 130.76 44.79 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.841 -1.388 . . . . 0.0 111.822 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.54 4.79 60.56 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.108 0.861 . . . . 0.0 114.054 -178.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -132.82 161.23 34.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.695 1.598 . . . . 0.0 110.594 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -138.17 120.18 15.51 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.046 1.738 . . . . 0.0 110.788 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.2 t -73.25 92.17 1.75 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 122.778 0.431 . . . . 0.0 110.579 177.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.4 t -80.35 160.22 25.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.936 1.694 . . . . 0.0 110.667 177.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.8 p -133.53 143.12 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.134 0.973 . . . . 0.0 111.0 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 36.1 m95 . . . . . 0 CA--C 1.537 0.462 0 C-N-CA 124.32 1.048 . . . . 0.0 110.335 177.936 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 . . . . . 0 N--CA 1.474 0.752 0 CA-C-O 121.3 0.571 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.599 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 73.9 m -51.32 -59.26 4.41 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 120.814 -1.179 . . . . 0.0 111.099 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.79 -32.76 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -63.11 -31.83 73.07 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.602 1.161 . . . . 0.0 110.994 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -95.09 -11.49 28.17 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.74 -1.124 . . . . 0.0 113.569 174.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.19 33.91 22.04 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 124.157 0.911 . . . . 0.0 112.397 -177.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -80.35 169.17 18.09 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 118.74 1.27 . . . . 0.0 112.342 175.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.851 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -114.84 117.58 4.08 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 123.648 0.642 . . . . 0.0 111.544 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.0 m -72.16 131.92 43.45 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.259 175.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 79.8 mt -147.87 156.39 44.32 Favored Pre-proline 0 C--O 1.218 -0.597 0 O-C-N 124.309 1.006 . . . . 0.0 111.224 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.469 ' HA ' HG21 ' A' ' 29' ' ' THR . 56.1 Cg_endo -66.3 139.66 55.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.089 2.526 . . . . 0.0 111.247 175.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -52.22 -20.68 2.78 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.1 t -66.74 -48.13 70.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.948 1.299 . . . . 0.0 112.611 170.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.44 -38.1 42.06 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.157 0.983 . . . . 0.0 111.361 177.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -87.61 125.86 63.81 Favored Pre-proline 0 CA--C 1.541 0.623 0 O-C-N 120.866 -1.146 . . . . 0.0 111.918 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -63.25 146.36 93.81 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.997 2.465 . . . . 0.0 110.691 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -52.2 -20.38 2.58 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.32 -35.76 30.58 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.867 1.667 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.44 ' HB1' ' OD1' ' A' ' 33' ' ' ASP . . . -83.01 -26.47 31.2 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 176.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -44.84 110.65 0.24 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.243 1.017 . . . . 0.0 111.429 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 33' ' ' ASP . 9.8 mt -95.72 175.15 6.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.475 1.131 . . . . 0.0 110.221 -178.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.1 p -127.13 29.23 5.63 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.361 1.064 . . . . 0.0 112.429 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.599 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 9.5 m-85 -71.5 -15.94 62.33 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 121.409 -0.807 . . . . 0.0 111.207 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.14 82.8 0.07 OUTLIER Glycine 0 CA--C 1.53 0.978 0 CA-C-O 124.395 2.108 . . . . 0.0 112.095 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 174.25 32.71 0.03 OUTLIER Glycine 0 C--O 1.227 -0.327 0 O-C-N 120.627 -1.514 . . . . 0.0 113.339 -176.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 19.3 m -131.45 165.98 22.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 122.408 0.283 . . . . 0.0 111.742 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.7 p -54.0 -46.61 71.81 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 124.666 1.229 . . . . 0.0 112.251 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.469 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.4 t -132.15 -54.84 0.98 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.577 1.151 . . . . 0.0 111.424 -178.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 p -149.82 140.77 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 122.296 1.046 . . . . 0.0 110.605 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 76.6 m -83.2 138.93 33.42 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.904 -1.123 . . . . 0.0 109.98 171.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.1 140.98 48.84 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 122.855 1.312 . . . . 0.0 111.056 173.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.44 ' OD1' ' HB1' ' A' ' 20' ' ' ALA . 1.2 p30 -76.29 106.84 8.14 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 124.123 1.916 . . . . 0.0 112.889 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.851 HD21 ' HA3' ' A' ' 9' ' ' GLY . 12.5 mt -67.06 -36.19 81.49 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 119.284 -2.135 . . . . 0.0 110.908 -178.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.5 p . . . . . 0 N--CA 1.467 0.407 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 179.545 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt . . . . . 0 C--O 1.226 -0.178 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.08 -38.32 65.92 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.604 0.621 . . . . 0.0 113.935 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -89.62 16.1 8.4 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.494 1.518 . . . . 0.0 112.882 176.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.69 34.37 87.22 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.147 0.403 . . . . 0.0 112.732 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.94 174.96 32.24 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-O 122.569 1.094 . . . . 0.0 112.111 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.93 136.27 28.41 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 122.424 1.107 . . . . 0.0 112.136 -177.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.5 t -73.53 123.45 23.96 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.899 -1.126 . . . . 0.0 112.488 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -127.28 147.09 60.56 Favored Pre-proline 0 CA--C 1.538 0.501 0 O-C-N 120.639 -1.288 . . . . 0.0 111.088 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -67.25 153.93 75.72 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.33 2.02 . . . . 0.0 110.565 176.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.568 HD11 ' HA2' ' A' ' 67' ' ' GLY . 13.7 mt -61.18 -18.46 58.31 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.0 -14.99 57.43 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.72 1.208 . . . . 0.0 112.258 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -88.93 139.8 30.09 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.705 -1.247 . . . . 0.0 110.009 175.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -96.7 122.33 39.52 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.841 0.856 . . . . 0.0 110.808 174.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.4 p -167.67 169.81 11.52 Favored 'General case' 0 C--O 1.214 -0.813 0 C-N-CA 123.224 0.61 . . . . 0.0 110.575 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -74.06 111.19 8.98 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.937 -0.477 . . . . 0.0 110.575 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.36 136.07 53.8 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.97 1.308 . . . . 0.0 111.369 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -84.09 143.6 29.59 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 120.885 -1.134 . . . . 0.0 110.734 176.658 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.03 -41.87 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.736 0.814 . . . . 0.0 113.089 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.73 -36.15 67.7 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.74 -0.6 . . . . 0.0 111.432 176.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.72 -30.9 51.95 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 121.853 -0.529 . . . . 0.0 111.242 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.416 ' HB2' ' CE ' ' A' ' 69' ' ' LYS . 28.3 p -55.27 -31.34 61.5 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 124.552 1.141 . . . . 0.0 111.722 178.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.93 -34.76 65.92 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 118.058 -0.973 . . . . 0.0 112.813 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.4 t -46.53 -53.08 12.03 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.362 1.465 . . . . 0.0 111.886 177.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 2.2 m -87.21 -56.54 3.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.401 174.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 39.48 -147.03 0.19 Allowed Glycine 0 C--O 1.217 -0.947 0 C-N-CA 125.599 1.571 . . . . 0.0 112.094 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 77.8 mttt 47.42 46.37 17.25 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.052 1.426 . . . . 0.0 113.909 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.568 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 81.63 19.8 65.21 Favored Glycine 0 CA--C 1.534 1.245 0 N-CA-C 114.241 0.456 . . . . 0.0 114.241 -174.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -139.23 150.98 46.16 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.941 1.696 . . . . 0.0 110.23 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -121.2 157.89 29.25 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.402 1.081 . . . . 0.0 109.954 178.046 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 50.6 t -101.5 96.28 7.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.652 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 33.8 m -89.67 144.22 26.17 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.16 0.584 . . . . 0.0 111.455 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.7 p -114.44 142.47 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.099 0.96 . . . . 0.0 110.186 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 32.0 m95 . . . . . 0 CA--C 1.517 -0.312 0 C-N-CA 123.627 0.771 . . . . 0.0 112.601 175.668 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 120.414 0.149 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -48.8 -59.28 3.69 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.517 -0.739 . . . . 0.0 111.168 176.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.56 -29.01 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.8 t -70.29 -30.03 66.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.442 1.097 . . . . 0.0 111.714 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.2 mmtt -94.4 -10.12 33.52 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 175.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.58 30.69 10.28 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-O 118.486 -1.175 . . . . 0.0 113.172 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -91.29 169.58 10.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.814 1.307 . . . . 0.0 112.062 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -122.33 133.92 9.49 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.102 0.858 . . . . 0.0 111.507 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 68.1 m -81.23 134.85 35.68 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 121.911 -0.758 . . . . 0.0 111.487 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.44 ' O ' HG12 ' A' ' 30' ' ' VAL . 38.6 mt -145.76 155.78 52.24 Favored Pre-proline 0 C--O 1.22 -0.463 0 O-C-N 124.066 0.854 . . . . 0.0 111.87 178.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.08 141.8 71.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 123.222 2.615 . . . . 0.0 110.852 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.424 ' HA ' HG11 ' A' ' 30' ' ' VAL . 87.4 mt-30 -54.11 -22.18 10.38 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.7 p -69.23 -46.17 68.01 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 125.409 1.483 . . . . 0.0 113.004 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.54 -37.42 56.7 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.991 0.916 . . . . 0.0 111.96 176.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.6 t -89.33 118.75 69.4 Favored Pre-proline 0 C--O 1.243 0.724 0 O-C-N 121.433 -0.792 . . . . 0.0 111.832 -178.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -63.23 150.58 88.2 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.711 2.274 . . . . 0.0 110.833 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -54.27 -20.49 7.18 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -82.81 -24.52 33.31 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.884 1.273 . . . . 0.0 113.815 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -97.26 -19.91 18.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.848 1.659 . . . . 0.0 112.059 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -53.78 118.85 4.28 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 121.063 -1.023 . . . . 0.0 110.558 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.479 HD12 ' HB3' ' A' ' 31' ' ' CYS . 5.3 mt -103.0 173.85 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.315 1.055 . . . . 0.0 110.519 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.1 p -127.15 28.5 5.74 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 0.0 112.176 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -69.63 -18.15 63.57 Favored 'General case' 0 C--O 1.207 -1.156 0 O-C-N 121.481 -0.762 . . . . 0.0 110.988 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.88 87.32 0.08 OUTLIER Glycine 0 CA--C 1.526 0.726 0 CA-C-O 124.174 1.986 . . . . 0.0 112.032 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.68 31.15 0.03 OUTLIER Glycine 0 C--O 1.221 -0.718 0 O-C-N 120.346 -1.679 . . . . 0.0 113.694 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.406 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 93.3 m -138.83 145.39 40.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.219 0.509 . . . . 0.0 110.488 176.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.3 t -60.81 -40.78 93.97 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 124.156 0.91 . . . . 0.0 111.447 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.7 p -108.65 -73.62 0.68 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.727 1.211 . . . . 0.0 111.066 -177.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 11' ' ' LEU . 7.9 p -150.76 148.36 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.864 1.266 . . . . 0.0 110.74 175.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.479 ' HB3' HD12 ' A' ' 22' ' ' LEU . 2.0 m -76.72 136.56 39.07 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 120.948 -1.095 . . . . 0.0 109.964 171.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -120.45 133.2 55.45 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 125.067 1.347 . . . . 0.0 112.114 175.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.29 100.19 5.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 122.915 1.341 . . . . 0.0 113.46 178.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mt -59.35 -35.3 73.6 Favored 'General case' 0 C--O 1.22 -0.477 0 O-C-N 120.606 -1.309 . . . . 0.0 111.439 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 N--CA 1.467 0.419 0 C-N-CA 123.933 0.893 . . . . 0.0 112.622 178.954 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.4 mttm . . . . . 0 C--O 1.221 -0.418 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -52.28 -30.11 31.58 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-N 118.809 0.731 . . . . 0.0 114.227 178.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -78.46 10.75 2.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.051 1.74 . . . . 0.0 113.45 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.31 35.12 77.09 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.503 1.049 . . . . 0.0 112.624 -175.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -104.64 -176.61 24.92 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-O 122.554 1.085 . . . . 0.0 113.309 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -146.62 150.19 34.98 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 123.167 1.46 . . . . 0.0 111.979 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 85.0 m -73.17 118.25 15.9 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.692 -1.255 . . . . 0.0 111.581 174.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -116.26 146.86 38.23 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.908 0.883 . . . . 0.0 111.011 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.81 153.19 76.32 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.693 2.262 . . . . 0.0 110.665 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.9 mt -59.75 -25.07 64.56 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -72.43 -21.16 61.29 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.608 1.163 . . . . 0.0 112.796 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -92.58 130.66 38.16 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.006 -1.059 . . . . 0.0 110.705 176.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.26 133.04 44.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.946 174.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.493 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 0.6 OUTLIER -168.7 178.45 4.66 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.025 0.53 . . . . 0.0 110.288 174.453 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttt -102.75 105.86 16.37 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 123.755 0.822 . . . . 0.0 110.618 175.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -122.14 137.81 54.69 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.285 1.034 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -80.56 136.5 36.27 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.535 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -48.67 -37.62 19.0 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.443 ' HB3' HD12 ' A' ' 57' ' ' LEU . . . -78.39 -29.29 47.2 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.788 0.835 . . . . 0.0 112.248 178.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -81.61 -30.23 32.96 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.503 0.721 . . . . 0.0 111.221 177.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.6 t -57.2 -29.61 63.85 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.427 1.491 . . . . 0.0 111.385 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.7 -33.72 66.73 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.334 1.054 . . . . 0.0 113.387 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.8 t -52.29 -61.03 2.53 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.149 0.979 . . . . 0.0 111.833 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.1 m -75.85 -52.43 10.38 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 37.8 -146.31 0.12 Allowed Glycine 0 C--N 1.344 1.016 0 C-N-CA 126.73 2.109 . . . . 0.0 111.455 -176.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mttp 45.81 43.91 10.35 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 119.944 1.872 . . . . 0.0 114.029 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.73 17.71 74.64 Favored Glycine 0 CA--C 1.539 1.566 0 O-C-N 121.544 -0.722 . . . . 0.0 114.899 -175.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -130.31 150.64 51.45 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.878 2.071 . . . . 0.0 109.612 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -115.78 158.81 22.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.584 1.554 . . . . 0.0 110.365 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 39.9 t -108.08 92.66 4.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.001 0.52 . . . . 0.0 111.041 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 48.7 t -81.96 163.84 21.89 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.774 0.321 . . . . 0.0 111.661 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 p -123.14 144.29 33.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.012 1.325 . . . . 0.0 111.693 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.493 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 46.1 m95 . . . . . 0 CA--C 1.532 0.253 0 C-N-CA 124.507 1.123 . . . . 0.0 111.859 173.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 121.039 0.447 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 66.8 m -53.69 -54.49 37.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.712 1.205 . . . . 0.0 110.757 175.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -55.83 -38.07 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.052 1.341 . . . . 0.0 113.456 175.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.9 m -66.65 -23.66 66.18 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.303 1.041 . . . . 0.0 112.462 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 2.5 mmmm -97.03 -3.87 40.69 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 170.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.53 43.1 20.35 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.724 0.678 . . . . 0.0 112.319 -176.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 40.4 m-85 -105.63 159.21 16.14 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.54 1.17 . . . . 0.0 112.836 173.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.443 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -108.84 131.05 10.35 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.405 1.002 . . . . 0.0 111.796 -178.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.97 130.98 44.32 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.462 0.705 . . . . 0.0 111.86 172.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.1 mt -139.6 162.21 52.46 Favored Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 123.376 0.422 . . . . 0.0 110.782 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.498 ' HA ' HG21 ' A' ' 29' ' ' THR . 57.7 Cg_endo -68.07 138.95 45.25 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.48 2.12 . . . . 0.0 111.509 172.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -53.38 -14.91 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 174.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.27 -48.68 19.32 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.735 2.014 . . . . 0.0 112.218 170.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -76.04 -33.64 59.63 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.576 1.151 . . . . 0.0 112.071 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 29.8 t -86.67 115.32 61.91 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 120.917 -1.115 . . . . 0.0 111.406 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -62.68 152.35 78.64 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.17 1.914 . . . . 0.0 110.914 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -57.64 -19.39 26.17 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.901 0.88 . . . . 0.0 113.093 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -81.5 -25.82 35.67 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.498 1.919 . . . . 0.0 114.531 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -101.38 -15.17 17.3 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.912 1.685 . . . . 0.0 112.707 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -53.72 106.29 0.18 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.958 1.303 . . . . 0.0 111.874 172.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.562 HD21 ' CG ' ' A' ' 33' ' ' ASP . 16.0 mt -89.71 165.54 14.14 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 122.252 1.025 . . . . 0.0 111.738 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 t -116.78 21.4 13.39 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.404 1.482 . . . . 0.0 111.936 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.523 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 43.1 m-85 -63.27 -18.59 63.74 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 174.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.24 66.46 2.65 Favored Glycine 0 N--CA 1.474 1.224 0 CA-C-N 120.567 1.531 . . . . 0.0 113.713 176.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.02 31.87 0.29 Allowed Glycine 0 N--CA 1.462 0.428 0 O-C-N 120.905 -1.35 . . . . 0.0 114.038 -175.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 49.0 m -137.83 164.54 28.67 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.057 0.943 . . . . 0.0 112.955 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 t -61.22 -31.28 71.06 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.498 HG21 ' HA ' ' A' ' 12' ' ' PRO . 3.1 t -139.98 -58.17 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.066 1.346 . . . . 0.0 111.716 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.426 ' H ' HG23 ' A' ' 29' ' ' THR . 5.5 p -147.3 155.23 11.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 122.088 0.947 . . . . 0.0 110.755 174.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 74.0 m -95.53 141.42 29.08 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 172.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -122.03 137.24 54.88 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.248 1.019 . . . . 0.0 111.787 177.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.562 ' CG ' HD21 ' A' ' 22' ' ' LEU . 5.1 m-20 -74.23 103.86 4.8 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 122.082 0.944 . . . . 0.0 110.96 -178.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.563 HD22 ' HB3' ' A' ' 41' ' ' LYS . 44.5 mt -57.42 -43.34 83.74 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.967 -1.083 . . . . 0.0 111.749 178.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.468 0.463 0 C-N-CA 124.467 1.107 . . . . 0.0 113.743 177.766 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.563 ' HB3' HD22 ' A' ' 34' ' ' LEU . 47.7 mttp . . . . . 0 N--CA 1.469 0.507 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.4 -36.8 64.1 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.083 0.849 . . . . 0.0 114.201 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -78.33 11.27 2.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.91 1.684 . . . . 0.0 113.448 172.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.39 18.59 63.4 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.239 1.876 . . . . 0.0 114.34 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.76 170.4 54.96 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 124.328 0.966 . . . . 0.0 112.742 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -137.96 142.61 40.5 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 122.733 1.254 . . . . 0.0 111.302 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.1 t -68.21 127.17 31.93 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.461 -0.774 . . . . 0.0 111.54 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -124.47 150.47 64.68 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 123.332 0.653 . . . . 0.0 111.887 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -71.12 157.44 57.55 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.384 2.056 . . . . 0.0 111.924 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -59.83 -27.35 66.56 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.45 -17.82 62.35 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.216 2.606 . . . . 0.0 113.08 176.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -88.14 129.17 35.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.944 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.88 121.36 21.74 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.272 0.629 . . . . 0.0 110.834 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -160.58 -176.93 5.86 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.989 1.316 . . . . 0.0 109.695 167.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.8 tppt? -92.71 126.08 37.63 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.904 1.282 . . . . 0.0 109.312 166.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.483 ' CD ' ' HE3' ' A' ' 69' ' ' LYS . 2.1 pm0 -124.9 146.98 49.07 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.325 1.45 . . . . 0.0 110.335 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -94.93 148.89 21.83 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.594 -0.691 . . . . 0.0 110.69 175.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -58.97 -42.56 90.2 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.0 0.92 . . . . 0.0 112.699 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.52 -30.09 57.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.3 1.04 . . . . 0.0 111.908 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.22 -37.44 20.09 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.053 0.941 . . . . 0.0 111.852 -178.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -58.07 -33.37 68.99 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.155 -1.591 . . . . 0.0 112.212 172.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.38 -41.69 72.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.54 0.736 . . . . 0.0 112.346 172.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.8 p -80.79 -19.65 44.3 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -63.82 -25.24 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.052 0.842 . . . . 0.0 111.619 174.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.11 163.12 16.72 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 122.419 1.011 . . . . 0.0 112.083 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.2 mttm -61.3 123.44 17.75 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.444 -1.033 . . . . 0.0 110.416 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.05 22.89 60.25 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.664 -1.076 . . . . 0.0 113.518 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -135.59 165.65 25.06 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.267 1.827 . . . . 0.0 111.452 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.483 ' HE3' ' CD ' ' A' ' 56' ' ' GLU . 54.6 mtpt -138.76 115.47 10.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.426 1.89 . . . . 0.0 111.941 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.3 t -73.39 104.94 4.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.91 -0.494 . . . . 0.0 110.921 -176.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.96 158.61 16.63 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.102 0.961 . . . . 0.0 110.994 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.7 m -132.48 145.41 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.712 1.605 . . . . 0.0 110.956 177.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 66.3 m95 . . . . . 0 N--CA 1.472 0.645 0 C-N-CA 124.736 1.214 . . . . 0.0 112.827 -176.466 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.1 m -54.42 -63.92 1.0 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.016 -1.052 . . . . 0.0 111.056 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.1 p -56.3 -35.2 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.447 0.699 . . . . 0.0 112.703 177.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.4 m -60.65 -29.48 69.29 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.64 1.176 . . . . 0.0 112.002 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -97.15 -8.94 28.91 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 172.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.7 32.4 30.32 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.836 -0.98 . . . . 0.0 113.2 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -78.62 170.16 17.1 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.336 1.568 . . . . 0.0 112.549 174.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.753 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -112.82 116.12 3.91 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 125.321 1.439 . . . . 0.0 111.081 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.43 129.9 38.07 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.694 -0.886 . . . . 0.0 111.699 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.1 mt -143.13 159.08 57.14 Favored Pre-proline 0 C--O 1.22 -0.457 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.888 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.412 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 59.3 Cg_endo -68.55 144.97 62.73 Favored 'Trans proline' 0 C--O 1.217 -0.563 0 C-N-CA 123.407 2.738 . . . . 0.0 112.549 173.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.453 ' OE1' HG21 ' A' ' 30' ' ' VAL . 20.5 mm-40 -53.04 -18.97 2.36 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 177.135 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.0 t -72.55 -49.19 34.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.694 2.397 . . . . 0.0 111.77 169.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -76.79 -34.2 57.97 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.369 1.067 . . . . 0.0 110.59 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.0 t -95.21 115.34 65.33 Favored Pre-proline 0 C--O 1.242 0.686 0 O-C-N 120.608 -1.308 . . . . 0.0 111.633 -175.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -62.83 153.61 71.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.958 2.438 . . . . 0.0 110.746 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -53.44 -31.93 47.53 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.46 -18.13 61.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.834 1.254 . . . . 0.0 113.239 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.39 -23.45 15.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.32 1.448 . . . . 0.0 113.599 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -53.07 117.71 3.2 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.305 -0.872 . . . . 0.0 110.759 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.479 HD12 ' SG ' ' A' ' 31' ' ' CYS . 2.5 mt -103.35 172.2 6.95 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.375 1.084 . . . . 0.0 111.195 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -117.83 25.51 10.32 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.122 1.369 . . . . 0.0 112.336 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -70.66 -14.66 62.55 Favored 'General case' 0 C--O 1.211 -0.956 0 C-N-CA 123.528 0.731 . . . . 0.0 111.964 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.33 85.19 0.02 OUTLIER Glycine 0 N--CA 1.469 0.858 0 CA-C-O 123.243 1.468 . . . . 0.0 113.627 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.16 29.51 0.02 OUTLIER Glycine 0 C--O 1.225 -0.458 0 O-C-N 120.604 -1.527 . . . . 0.0 114.202 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.7 m -129.7 158.71 38.62 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.475 1.11 . . . . 0.0 111.169 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.6 m -47.68 -48.57 29.09 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.399 1.08 . . . . 0.0 112.785 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -128.22 -59.03 1.19 Allowed 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.518 1.527 . . . . 0.0 110.961 179.62 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.453 HG21 ' OE1' ' A' ' 13' ' ' GLN . 7.6 p -145.06 145.14 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 122.886 1.327 . . . . 0.0 109.676 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.479 ' SG ' HD12 ' A' ' 22' ' ' LEU . 1.8 t -82.59 139.16 33.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.561 171.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -117.73 132.88 56.41 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.955 1.702 . . . . 0.0 110.781 174.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.455 ' HB3' HD21 ' A' ' 22' ' ' LEU . 0.7 OUTLIER -74.16 103.49 4.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 123.28 1.514 . . . . 0.0 112.319 176.27 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.753 HD21 ' HA3' ' A' ' 9' ' ' GLY . 16.6 mt -55.06 -42.25 72.49 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.697 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 N--CA 1.471 0.619 0 C-N-CA 125.529 1.532 . . . . 0.0 113.205 179.766 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.499 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.224 -0.275 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.97 -36.66 74.71 Favored Glycine 0 CA--C 1.533 1.189 0 O-C-N 123.711 0.632 . . . . 0.0 113.247 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.3 mtmm -86.36 16.43 4.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.465 1.906 . . . . 0.0 114.137 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.12 47.69 79.23 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.46 1.028 . . . . 0.0 112.993 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -101.34 164.36 18.0 Favored Glycine 0 C--O 1.244 0.728 0 C-N-CA 124.799 1.19 . . . . 0.0 113.953 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -133.3 145.97 50.93 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.905 1.682 . . . . 0.0 110.625 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.9 m -73.28 121.04 19.73 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.088 -1.008 . . . . 0.0 111.113 175.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -120.23 150.01 50.63 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.998 0.919 . . . . 0.0 111.187 177.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -68.95 154.11 71.42 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.434 2.089 . . . . 0.0 110.553 176.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.498 HD23 ' HD3' ' A' ' 69' ' ' LYS . 82.7 mt -60.29 -20.83 60.74 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 174.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -70.54 -17.27 62.93 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.372 1.869 . . . . 0.0 111.952 173.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -92.94 132.35 37.13 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 120.667 -1.27 . . . . 0.0 110.44 177.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -90.05 119.29 30.28 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.627 0.771 . . . . 0.0 110.376 174.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -167.26 166.58 14.69 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.769 1.227 . . . . 0.0 110.241 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.3 tttt -71.48 112.11 7.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.477 1.111 . . . . 0.0 108.928 175.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.462 ' HG2' ' CE ' ' A' ' 69' ' ' LYS . 1.9 pp20? -120.15 142.85 48.58 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 124.003 0.921 . . . . 0.0 109.618 175.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -98.27 141.18 31.49 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.603 0.761 . . . . 0.0 111.191 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -62.21 -39.61 93.34 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.073 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.49 -32.34 58.27 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.707 0.765 . . . . 0.0 111.772 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.06 -35.56 56.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.9 t -52.18 -34.82 46.89 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.998 1.319 . . . . 0.0 112.359 174.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.97 63.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.242 1.017 . . . . 0.0 112.734 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 40.4 t -60.08 -54.98 39.51 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.037 1.735 . . . . 0.0 111.176 175.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 87.5 m -63.19 -43.17 98.97 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 117.88 176.85 17.2 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 122.716 1.175 . . . . 0.0 113.098 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -62.42 131.75 50.26 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.793 -0.828 . . . . 0.0 111.597 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.82 -2.87 82.68 Favored Glycine 0 CA--C 1.531 1.064 0 CA-C-O 118.345 -1.253 . . . . 0.0 113.942 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.2 164.12 16.72 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.396 1.878 . . . . 0.0 109.656 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.498 ' HD3' HD23 ' A' ' 50' ' ' LEU . 23.7 mtpt -133.55 125.09 28.1 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.239 1.816 . . . . 0.0 109.725 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 t -78.61 100.4 6.97 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 122.855 0.462 . . . . 0.0 111.035 176.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.47 136.66 38.27 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.648 0.737 . . . . 0.0 111.043 176.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.6 m -103.66 144.46 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.154 0.982 . . . . 0.0 111.21 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.8 m95 . . . . . 0 CA--C 1.531 0.221 0 C-N-CA 123.374 0.67 . . . . 0.0 111.326 179.047 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 121.678 0.752 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.3 m -56.91 -57.55 12.02 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 121.175 -0.953 . . . . 0.0 110.638 178.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.26 -33.01 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.66 -0.65 . . . . 0.0 112.384 177.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -62.29 -31.13 71.68 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.329 0.652 . . . . 0.0 111.28 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.41 ' HB2' ' CD2' ' A' ' 8' ' ' PHE . 28.3 mmtm -96.95 -10.44 26.32 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.24 45.5 4.08 Favored Glycine 0 C--O 1.222 -0.651 0 CA-C-O 118.423 -1.209 . . . . 0.0 111.324 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.506 ' CE2' ' CZ ' ' A' ' 24' ' ' TYR . 77.3 m-85 -108.27 163.25 13.35 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.121 0.96 . . . . 0.0 111.358 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 131.84 10.42 Favored Glycine 0 CA--C 1.523 0.536 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.781 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.8 m -80.43 118.99 22.54 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.048 177.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 30' ' ' VAL . 30.6 mt -132.93 154.95 81.6 Favored Pre-proline 0 C--O 1.211 -0.944 0 O-C-N 124.171 0.92 . . . . 0.0 112.025 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.52 141.21 72.67 Favored 'Trans proline' 0 C--O 1.213 -0.769 0 C-N-CA 124.394 3.396 . . . . 0.0 110.395 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.594 ' HA ' HG11 ' A' ' 30' ' ' VAL . 1.1 pt20 -49.79 -30.97 10.63 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.896 0.879 . . . . 0.0 112.594 177.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 t -65.85 -44.53 85.18 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.185 1.179 . . . . 0.0 114.185 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.408 ' OD1' HD13 ' A' ' 11' ' ' LEU . 8.2 t70 -70.5 -47.57 59.86 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.392 0.677 . . . . 0.0 112.363 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -86.0 128.74 56.84 Favored Pre-proline 0 CA--C 1.541 0.615 0 CA-C-O 121.422 0.629 . . . . 0.0 111.9 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -65.5 144.71 80.32 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.289 1.992 . . . . 0.0 110.958 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -51.85 -19.74 1.88 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 173.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -78.31 -36.11 46.92 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.779 0.832 . . . . 0.0 112.792 176.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.72 -28.31 26.4 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 116.026 -1.94 . . . . 0.0 110.776 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.535 ' HG2' HG21 ' A' ' 30' ' ' VAL . 84.0 mtt180 -44.14 119.82 1.92 Allowed 'General case' 0 C--N 1.345 0.396 0 O-C-N 125.105 1.503 . . . . 0.0 110.625 178.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.486 HD13 ' CE2' ' A' ' 24' ' ' TYR . 3.4 mt -103.18 178.4 4.57 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.2 p -121.35 30.26 6.86 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.157 0.983 . . . . 0.0 111.109 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.506 ' CZ ' ' CE2' ' A' ' 8' ' ' PHE . 62.7 m-85 -69.14 -19.18 64.02 Favored 'General case' 0 C--O 1.202 -1.409 0 CA-C-O 119.085 -0.483 . . . . 0.0 110.461 177.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.53 49.68 75.91 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 120.768 1.622 . . . . 0.0 111.804 178.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -143.23 36.67 1.56 Allowed Glycine 0 C--O 1.223 -0.592 0 CA-C-O 117.944 -1.476 . . . . 0.0 112.703 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 91.5 m -144.94 151.25 38.35 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 117.59 0.695 . . . . 0.0 111.4 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 p -63.22 -43.22 98.72 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 123.652 0.595 . . . . 0.0 111.558 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.1 p -105.93 -74.67 0.65 Allowed 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.001 0.52 . . . . 0.0 109.744 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.594 HG11 ' HA ' ' A' ' 13' ' ' GLN . 9.9 p -151.92 144.42 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 123.499 1.619 . . . . 0.0 111.336 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.8 t -80.34 128.24 33.33 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 120.594 -1.316 . . . . 0.0 111.059 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -106.43 138.27 42.92 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 124.049 0.843 . . . . 0.0 112.033 177.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -83.11 104.66 13.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.6 mt -65.26 -30.39 71.26 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 120.837 -1.164 . . . . 0.0 110.854 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 p . . . . . 0 N--CA 1.464 0.265 0 O-C-N 120.484 -1.385 . . . . 0.0 112.634 178.546 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp . . . . . 0 C--O 1.216 -0.664 0 CA-C-O 119.242 -0.408 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.68 -31.67 45.74 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 122.994 0.331 . . . . 0.0 112.854 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -77.05 14.53 0.85 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.69 32.87 85.64 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 123.958 0.789 . . . . 0.0 112.091 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.411 ' CA ' ' HA ' ' A' ' 72' ' ' VAL . . . -99.74 179.2 30.21 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 122.091 0.828 . . . . 0.0 113.168 178.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -146.8 153.67 40.46 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 123.218 1.485 . . . . 0.0 111.719 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.1 m -67.48 131.68 46.15 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.702 -1.249 . . . . 0.0 113.196 172.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -130.44 148.87 71.66 Favored Pre-proline 0 N--CA 1.452 -0.366 0 CA-C-O 121.65 0.738 . . . . 0.0 111.594 178.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.86 152.28 77.45 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.584 2.189 . . . . 0.0 111.405 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.634 HD23 ' HG3' ' A' ' 69' ' ' LYS . 12.9 mt -63.49 -18.96 64.34 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 176.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -81.34 -12.7 58.94 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.724 0.81 . . . . 0.0 111.399 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -94.19 136.09 34.86 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 120.965 -1.085 . . . . 0.0 110.444 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -86.19 123.2 31.21 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.986 176.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -169.74 -176.86 2.5 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.48 0.712 . . . . 0.0 111.156 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -97.4 109.02 21.86 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.611 0.764 . . . . 0.0 112.837 174.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -113.05 137.51 51.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.133 0.968 . . . . 0.0 110.987 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -83.28 145.34 29.15 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.53 176.237 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.404 ' N ' HD13 ' A' ' 57' ' ' LEU . 40.9 mm-40 -66.75 -42.59 85.95 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.594 0.711 . . . . 0.0 112.776 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.48 -32.53 64.35 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.474 -0.766 . . . . 0.0 111.869 177.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -78.22 -39.5 40.27 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.409 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.5 p -53.18 -32.62 48.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 124.721 1.209 . . . . 0.0 112.0 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.22 -30.28 64.44 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.1 p -61.36 -51.45 68.77 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 123.39 0.676 . . . . 0.0 111.665 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.4 t -66.23 -33.91 76.82 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.55 0.34 . . . . 0.0 110.117 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -178.92 27.99 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 123.291 1.495 . . . . 0.0 112.155 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -64.14 154.01 35.98 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.208 -1.172 . . . . 0.0 111.361 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.588 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 72.21 8.84 71.09 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.745 -178.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -143.06 157.24 44.71 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.048 0.939 . . . . 0.0 110.604 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.634 ' HG3' HD23 ' A' ' 50' ' ' LEU . 5.6 mtmp? -128.53 120.65 27.17 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.384 0.674 . . . . 0.0 111.001 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.3 t -80.15 102.09 9.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.212 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.19 168.26 14.14 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 175.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.411 ' HA ' ' CA ' ' A' ' 45' ' ' GLY . 8.0 p -128.43 144.44 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 C-N-CA 123.763 0.825 . . . . 0.0 111.237 177.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 23.8 m95 . . . . . 0 CA--C 1.517 -0.297 0 CA-C-O 121.89 0.852 . . . . 0.0 111.786 175.989 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 . . . . . 0 C--O 1.212 -0.883 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -46.26 -56.04 6.32 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 121.411 -0.806 . . . . 0.0 110.99 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.9 -23.88 21.97 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.634 0 CA-C-O 121.054 0.454 . . . . 0.0 111.681 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 t -64.66 -35.13 80.04 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 121.516 0.674 . . . . 0.0 111.203 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.497 ' HD3' ' CD2' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -97.23 -13.75 21.83 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.811 -0.556 . . . . 0.0 111.602 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.2 29.84 7.33 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 119.018 -0.879 . . . . 0.0 112.621 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.441 ' CD2' ' HB2' ' A' ' 6' ' ' LYS . 57.4 m-85 -85.38 173.89 9.96 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.374 0.587 . . . . 0.0 111.389 179.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.2 131.71 7.3 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.644 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.8 m -83.73 132.18 34.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 122.608 -0.348 . . . . 0.0 111.134 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.0 mt -151.24 154.66 34.11 Favored Pre-proline 0 C--O 1.199 -1.555 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.27 137.54 40.47 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.84 3.027 . . . . 0.0 111.626 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.405 ' CG ' HG11 ' A' ' 30' ' ' VAL . 87.2 mt-30 -46.82 -31.27 2.93 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 123.111 0.564 . . . . 0.0 110.437 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.7 t -57.78 -43.95 85.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 121.782 -0.574 . . . . 0.0 112.368 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -86.4 -33.66 20.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.548 0.69 . . . . 0.0 112.117 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.5 t -90.63 125.22 60.2 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-O 121.498 0.666 . . . . 0.0 111.345 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.47 148.93 74.13 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.024 2.482 . . . . 0.0 111.712 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -14.59 6.15 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.054 0.541 . . . . 0.0 111.844 177.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -85.82 -23.71 27.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.84 0.456 . . . . 0.0 112.116 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.405 ' HB1' ' H ' ' A' ' 33' ' ' ASP . . . -98.2 -25.41 14.9 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 122.74 0.416 . . . . 0.0 111.114 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.523 ' HD3' HG21 ' A' ' 30' ' ' VAL . 63.0 mtt180 -46.9 123.44 5.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.344 0.658 . . . . 0.0 110.3 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.0 mt -107.99 177.07 4.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.343 0.592 . . . . 0.0 110.406 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.8 m -133.04 36.36 3.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.816 0.817 . . . . 0.0 111.341 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.497 ' CD2' ' HD3' ' A' ' 6' ' ' LYS . 11.3 m-85 -71.54 -18.35 62.27 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 121.716 -0.615 . . . . 0.0 110.74 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.9 82.79 0.12 Allowed Glycine 0 C--O 1.22 -0.731 0 CA-C-O 122.83 1.239 . . . . 0.0 111.728 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 178.87 26.46 0.04 OUTLIER Glycine 0 C--O 1.22 -0.726 0 O-C-N 120.545 -1.562 . . . . 0.0 113.245 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 86.5 m -129.75 149.97 51.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.595 0.358 . . . . 0.0 111.477 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.4 p -63.97 -39.83 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.189 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.9 p -112.39 -75.22 0.61 Allowed 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 121.358 0.599 . . . . 0.0 110.627 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.523 HG21 ' HD3' ' A' ' 21' ' ' ARG . 7.1 p -152.99 134.11 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-O 123.387 1.565 . . . . 0.0 111.057 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 m -69.83 138.05 52.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 120.124 -1.61 . . . . 0.0 111.513 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -114.12 148.77 36.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.151 0.501 . . . . 0.0 111.084 178.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.405 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 8.5 t70 -92.25 106.33 18.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.163 0.506 . . . . 0.0 110.848 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 mt -66.87 -35.0 79.03 Favored 'General case' 0 C--O 1.219 -0.548 0 O-C-N 121.849 -0.532 . . . . 0.0 110.879 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.332 -0.18 0 C-N-CA 122.58 0.352 . . . . 0.0 111.542 178.968 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.307 0 CA-C-O 120.814 0.34 . . . . 0.0 110.79 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.82 -42.79 92.12 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -79.58 9.43 4.98 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.675 0.39 . . . . 0.0 111.658 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.17 38.85 24.91 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 112.337 -0.305 . . . . 0.0 112.337 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.94 173.37 19.09 Favored Glycine 0 N--CA 1.451 -0.35 0 O-C-N 122.591 -0.359 . . . . 0.0 112.506 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -151.71 157.32 41.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.158 0.98 . . . . 0.0 111.639 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 t -71.95 133.39 45.34 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 121.409 -0.807 . . . . 0.0 111.612 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -133.84 147.74 65.5 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 122.021 0.915 . . . . 0.0 111.65 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.28 156.19 66.6 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.943 2.429 . . . . 0.0 112.111 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.464 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 18.3 mt -60.25 -16.44 33.81 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.609 178.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -80.69 -14.38 58.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.425 0.631 . . . . 0.0 111.49 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -90.93 147.37 23.17 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 121.378 -0.826 . . . . 0.0 110.746 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -106.68 122.07 45.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.357 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -174.74 164.87 3.64 Favored 'General case' 0 C--O 1.2 -1.525 0 C-N-CA 122.739 0.415 . . . . 0.0 111.877 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm -75.25 113.4 12.57 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.637 -0.664 . . . . 0.0 110.296 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.21 132.57 46.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 122.188 0.994 . . . . 0.0 110.842 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 tp -80.96 132.29 35.39 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.084 -1.01 . . . . 0.0 110.588 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -55.88 -39.3 71.34 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 122.154 -0.341 . . . . 0.0 111.575 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.77 70.21 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.691 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -78.68 -36.72 43.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 122.411 0.285 . . . . 0.0 111.51 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 18.6 m -51.96 -37.79 54.24 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 123.411 0.684 . . . . 0.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.27 -28.36 58.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.9 m -56.93 -58.27 8.9 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.237 0.615 . . . . 0.0 110.805 179.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.3 m -60.16 -37.97 81.76 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.137 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 119.31 -156.41 15.75 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-O 122.173 0.874 . . . . 0.0 111.871 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.5 pttt -89.25 133.14 34.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 O-C-N 121.614 -0.933 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 13.74 60.38 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 121.188 -0.529 . . . . 0.0 113.032 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -144.56 150.0 36.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.865 0.466 . . . . 0.0 111.034 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.464 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 16.5 mmtp -127.95 122.03 31.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.434 0.635 . . . . 0.0 111.456 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -78.47 110.51 13.61 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.822 -0.549 . . . . 0.0 111.431 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 95.6 m -99.46 162.61 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.509 0.671 . . . . 0.0 111.509 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.1 p -119.18 144.55 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.816 -0.553 . . . . 0.0 110.971 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 29.6 m95 . . . . . 0 C--N 1.325 -0.478 0 CA-C-O 121.544 0.688 . . . . 0.0 111.056 178.577 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 110.475 -0.194 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -50.9 -48.05 60.6 Favored 'General case' 0 C--N 1.342 0.25 0 O-C-N 121.644 -0.66 . . . . 0.0 111.853 177.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.6 p -57.17 -29.96 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 t -71.17 -29.59 65.38 Favored 'General case' 0 C--O 1.23 0.043 0 C-N-CA 124.252 1.021 . . . . 0.0 111.247 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.473 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -94.02 -11.81 29.98 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 174.452 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.98 45.76 4.7 Favored Glycine 0 C--O 1.224 -0.504 0 O-C-N 124.339 1.025 . . . . 0.0 111.693 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.455 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 54.0 m-85 -111.21 163.75 13.59 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.401 1.101 . . . . 0.0 111.369 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.94 136.08 12.66 Favored Glycine 0 CA--C 1.522 0.504 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 83.3 m -80.56 125.36 29.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.621 176.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.633 HD13 ' OD2' ' A' ' 15' ' ' ASP . 48.7 mt -137.7 155.94 74.84 Favored Pre-proline 0 C--O 1.214 -0.799 0 O-C-N 124.01 0.819 . . . . 0.0 112.078 179.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.1 140.81 67.05 Favored 'Trans proline' 0 C--O 1.214 -0.697 0 C-N-CA 124.254 3.303 . . . . 0.0 110.255 178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.589 ' HA ' HG11 ' A' ' 30' ' ' VAL . 1.0 OUTLIER -49.5 -31.0 9.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.959 0.903 . . . . 0.0 112.745 176.68 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.0 t -66.13 -44.92 82.84 Favored 'General case' 0 C--O 1.224 -0.289 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.633 ' OD2' HD13 ' A' ' 11' ' ' LEU . 25.3 t70 -72.41 -44.97 61.71 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.571 0.748 . . . . 0.0 112.475 175.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.408 ' SG ' ' HB3' ' A' ' 20' ' ' ALA . 13.9 t -89.51 124.68 63.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 121.444 -0.785 . . . . 0.0 112.278 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -64.01 149.27 90.87 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.694 2.263 . . . . 0.0 111.206 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -54.2 -18.15 3.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -79.34 -32.66 43.35 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.968 0.907 . . . . 0.0 113.198 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.408 ' HB3' ' SG ' ' A' ' 16' ' ' CYS . . . -90.02 -23.2 21.55 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.686 177.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.656 ' HG2' HG21 ' A' ' 30' ' ' VAL . 95.4 mtt180 -45.48 116.49 1.17 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.938 0.895 . . . . 0.0 110.701 178.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.587 HD12 ' HB3' ' A' ' 31' ' ' CYS . 15.1 mt -95.52 177.27 5.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 122.339 1.066 . . . . 0.0 109.267 -178.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.1 m -130.4 28.68 4.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.192 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.473 ' CE1' ' HG3' ' A' ' 6' ' ' LYS . 37.7 m-85 -70.4 -19.36 63.01 Favored 'General case' 0 C--O 1.211 -0.936 0 O-C-N 121.891 -0.505 . . . . 0.0 111.525 177.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.89 78.87 0.26 Allowed Glycine 0 CA--C 1.527 0.839 0 CA-C-O 124.19 1.995 . . . . 0.0 111.555 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.29 27.88 0.09 OUTLIER Glycine 0 C--O 1.218 -0.86 0 O-C-N 118.968 -2.489 . . . . 0.0 112.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 84.5 m -135.62 143.48 45.58 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 117.863 0.831 . . . . 0.0 111.125 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.8 m -61.6 -33.99 74.86 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.519 1.137 . . . . 0.0 111.531 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 54.3 p -113.23 -76.0 0.59 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 123.184 0.593 . . . . 0.0 111.011 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.656 HG21 ' HG2' ' A' ' 21' ' ' ARG . 8.6 p -151.69 145.19 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 123.255 1.502 . . . . 0.0 111.261 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.587 ' HB3' HD12 ' A' ' 22' ' ' LEU . 1.9 m -81.17 137.04 35.93 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 120.07 -1.644 . . . . 0.0 110.303 175.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.07 141.08 46.18 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.654 0.782 . . . . 0.0 112.165 176.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.577 ' HB2' HD21 ' A' ' 22' ' ' LEU . 17.7 t0 -83.57 104.61 13.84 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.904 0.859 . . . . 0.0 110.434 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.487 HD22 ' HE2' ' A' ' 41' ' ' LYS . 60.7 mt -66.08 -32.61 74.17 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 121.432 -0.792 . . . . 0.0 110.992 177.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.1 m . . . . . 0 C--N 1.322 -0.594 0 O-C-N 119.544 -1.973 . . . . 0.0 112.45 177.289 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.487 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.511 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -62.48 -37.88 95.41 Favored Glycine 0 C--O 1.219 -0.808 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -177.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -78.87 15.93 0.99 Allowed 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.971 0.908 . . . . 0.0 112.508 174.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 65.89 30.54 77.33 Favored Glycine 0 CA--C 1.529 0.932 0 O-C-N 121.386 -0.821 . . . . 0.0 112.078 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.62 166.4 54.14 Favored Glycine 0 CA--C 1.524 0.653 0 O-C-N 122.033 -0.687 . . . . 0.0 112.388 177.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -144.44 154.73 43.25 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.656 1.217 . . . . 0.0 111.206 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.4 109.09 4.01 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.573 -0.704 . . . . 0.0 112.491 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -106.81 148.7 37.38 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 121.805 0.812 . . . . 0.0 111.993 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -67.14 153.54 77.21 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.55 2.167 . . . . 0.0 110.99 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.422 HD22 ' HE3' ' A' ' 69' ' ' LYS . 18.5 mt -60.21 -16.45 33.5 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 174.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -78.25 -18.21 55.65 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.098 0.959 . . . . 0.0 112.258 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -87.38 145.65 26.22 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.455 -1.403 . . . . 0.0 110.822 176.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -98.95 121.96 41.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.886 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -174.17 161.27 3.52 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 123.832 0.853 . . . . 0.0 111.202 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.19 110.52 6.7 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 122.702 0.401 . . . . 0.0 110.748 177.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.442 ' OE1' ' HB3' ' A' ' 61' ' ' SER . 0.8 OUTLIER -125.11 133.57 52.81 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.619 1.199 . . . . 0.0 110.112 178.191 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.531 HD23 ' HG2' ' A' ' 60' ' ' GLU . 22.1 tp -82.48 129.21 34.86 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 171.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -51.67 -40.01 59.28 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.441 -0.787 . . . . 0.0 113.002 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.45 -24.75 67.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.273 1.029 . . . . 0.0 111.998 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' HD23 ' A' ' 57' ' ' LEU . 27.2 mm-40 -91.17 -42.5 10.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.662 1.185 . . . . 0.0 113.489 176.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.442 ' HB3' ' OE1' ' A' ' 56' ' ' GLU . 24.8 p -52.24 -26.68 12.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.739 0.699 . . . . 0.0 112.82 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.27 85.16 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 175.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.5 t -67.33 -50.26 60.77 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.186 0.994 . . . . 0.0 111.635 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 10.8 m -51.71 -38.32 54.65 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.667 0.387 . . . . 0.0 112.043 178.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 121.08 156.36 9.78 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.808 1.227 . . . . 0.0 111.036 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -51.68 129.97 27.3 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.168 -1.195 . . . . 0.0 110.992 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.71 12.14 64.79 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -135.63 157.21 47.43 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 124.101 0.961 . . . . 0.0 110.445 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.422 ' HE3' HD22 ' A' ' 50' ' ' LEU . 73.7 mttt -135.17 120.58 19.14 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 124.834 1.253 . . . . 0.0 110.34 -178.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.78 98.84 0.56 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.447 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 65.8 m -97.31 159.85 14.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.738 1.256 . . . . 0.0 111.351 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -111.97 145.29 18.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 O-C-N 121.522 -0.736 . . . . 0.0 110.92 177.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.9 m95 . . . . . 0 CA--C 1.51 -0.571 0 CA-C-O 117.609 -1.186 . . . . 0.0 113.889 178.97 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 . . . . . 0 N--CA 1.472 0.639 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.581 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 68.3 m -51.32 -60.16 3.43 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.732 1.213 . . . . 0.0 110.102 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -57.54 -33.71 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 175.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t -64.79 -26.87 68.53 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.983 1.313 . . . . 0.0 111.793 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 -10.65 23.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.505 174.078 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.15 30.83 21.64 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 124.32 0.962 . . . . 0.0 113.666 -177.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -82.39 165.32 20.39 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.249 1.024 . . . . 0.0 112.776 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.2 123.2 6.59 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.609 1.1 . . . . 0.0 111.721 178.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -72.85 131.53 42.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.636 -0.92 . . . . 0.0 111.878 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.5 mt -140.99 161.84 51.54 Favored Pre-proline 0 CA--C 1.535 0.369 0 O-C-N 124.007 0.817 . . . . 0.0 111.107 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.98 142.27 50.9 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.364 2.043 . . . . 0.0 111.067 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.45 -20.39 7.47 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -70.24 -46.81 63.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.049 1.34 . . . . 0.0 112.525 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.29 -39.08 49.25 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.334 1.053 . . . . 0.0 111.076 176.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.8 t -86.68 110.92 36.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 O-C-N 120.481 -1.387 . . . . 0.0 112.024 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -61.24 150.29 85.34 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.911 2.407 . . . . 0.0 110.434 -178.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -49.97 -23.68 2.15 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 176.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -72.46 -42.49 64.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.465 1.906 . . . . 0.0 111.818 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.26 -20.6 31.92 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.337 -1.316 . . . . 0.0 113.049 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -52.14 106.39 0.15 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.282 1.401 . . . . 0.0 111.802 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.703 HD21 ' HB2' ' A' ' 33' ' ' ASP . 17.0 mt -90.19 172.7 8.61 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.826 0.822 . . . . 0.0 111.259 -179.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 m -123.72 27.36 7.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 112.786 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.581 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 11.8 m-85 -71.75 -15.81 62.19 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.371 0.668 . . . . 0.0 111.489 178.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.99 80.43 0.09 OUTLIER Glycine 0 N--CA 1.468 0.818 0 CA-C-O 123.63 1.684 . . . . 0.0 112.432 175.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -178.39 28.27 0.06 OUTLIER Glycine 0 C--O 1.223 -0.587 0 O-C-N 120.509 -1.583 . . . . 0.0 114.904 -176.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 52.0 m -133.7 159.71 39.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 123.54 0.736 . . . . 0.0 110.981 175.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.2 m -52.39 -48.59 65.54 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 124.175 0.99 . . . . 0.0 112.927 -179.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.58 -61.52 1.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.34 1.456 . . . . 0.0 110.557 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.3 p -144.35 153.27 15.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.682 0.753 . . . . 0.0 111.294 176.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 82.9 m -90.77 136.5 33.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.741 0.816 . . . . 0.0 109.109 171.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -114.29 137.37 51.88 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.995 1.318 . . . . 0.0 111.821 174.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.703 ' HB2' HD21 ' A' ' 22' ' ' LEU . 19.5 t0 -81.71 101.52 10.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.027 -179.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 mt -62.75 -35.53 80.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.954 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.472 0.629 0 C-N-CA 125.524 1.53 . . . . 0.0 111.522 176.909 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.1 mmtp . . . . . 0 C--O 1.222 -0.354 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.32 -38.37 61.96 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 123.44 0.543 . . . . 0.0 113.372 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.3 mttm -80.15 11.84 3.22 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.943 1.697 . . . . 0.0 114.061 174.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.36 30.78 72.09 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.594 1.092 . . . . 0.0 113.276 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.64 163.7 40.7 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 123.507 0.575 . . . . 0.0 112.69 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -125.87 144.7 50.56 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.469 1.507 . . . . 0.0 111.115 -178.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.25 128.88 38.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 121.132 -0.98 . . . . 0.0 110.332 176.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -130.74 146.8 63.53 Favored Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 121.45 -0.781 . . . . 0.0 111.654 177.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -66.06 157.86 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.368 2.045 . . . . 0.0 110.428 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.3 mt -62.08 -22.2 65.58 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -77.86 -13.43 59.89 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.646 1.578 . . . . 0.0 113.078 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -87.49 135.46 33.34 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 120.429 -1.419 . . . . 0.0 110.0 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -99.94 123.51 44.26 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.238 1.415 . . . . 0.0 110.371 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -165.65 178.55 6.58 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 125.275 1.43 . . . . 0.0 109.805 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -80.42 110.42 15.85 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 121.446 -0.784 . . . . 0.0 110.302 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -121.9 133.31 54.86 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.452 1.101 . . . . 0.0 111.35 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.561 HD23 ' OE1' ' A' ' 60' ' ' GLU . 13.3 tp -88.44 133.63 34.07 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.914 -1.116 . . . . 0.0 109.344 173.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -50.3 -40.38 48.41 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.029 1.732 . . . . 0.0 113.813 172.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.6 -25.75 66.77 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.791 1.236 . . . . 0.0 112.381 176.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.561 ' OE1' HD23 ' A' ' 57' ' ' LEU . 1.1 mp0 -94.13 -28.49 15.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.233 1.013 . . . . 0.0 112.718 174.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.0 t -51.66 -38.5 55.19 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 125.658 1.583 . . . . 0.0 111.638 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.14 -44.13 67.52 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.289 1.436 . . . . 0.0 113.474 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 t -44.58 -55.96 4.73 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.138 1.775 . . . . 0.0 112.753 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 18.0 m -77.12 -58.48 3.26 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.485 172.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 36.87 -146.07 0.08 OUTLIER Glycine 0 N--CA 1.472 1.057 0 C-N-CA 128.504 2.954 . . . . 0.0 112.255 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 pttt 42.05 42.83 2.53 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 121.142 2.471 . . . . 0.0 117.174 172.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 86.26 17.05 61.47 Favored Glycine 0 CA--C 1.542 1.726 0 N-CA-C 115.36 0.904 . . . . 0.0 115.36 -174.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -142.16 152.55 43.3 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.042 2.537 . . . . 0.0 109.957 -177.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -129.09 160.84 31.54 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.842 -1.161 . . . . 0.0 109.986 176.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 47.6 t -97.91 107.41 19.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.394 0.678 . . . . 0.0 110.779 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.41 152.1 23.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.167 0.508 . . . . 0.0 110.978 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -117.93 146.8 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.093 0.957 . . . . 0.0 110.986 176.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.7 m95 . . . . . 0 N--CA 1.466 0.329 0 C-N-CA 124.112 0.965 . . . . 0.0 111.771 178.443 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 N--CA 1.469 0.515 0 N-CA-C 111.337 0.125 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -50.16 -48.22 54.02 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.409 0.683 . . . . 0.0 111.823 176.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.29 -33.91 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 124.78 1.232 . . . . 0.0 113.21 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -68.39 -28.18 66.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.138 1.375 . . . . 0.0 112.066 177.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -96.57 -5.69 38.62 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.04 40.84 28.92 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.862 0.755 . . . . 0.0 113.533 -176.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.51 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 57.0 m-85 -94.9 167.21 11.56 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.334 1.054 . . . . 0.0 112.918 172.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.51 127.5 7.89 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.437 1.018 . . . . 0.0 111.627 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.6 m -72.41 134.29 45.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.782 -0.834 . . . . 0.0 111.865 171.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 33.0 mt -142.73 163.47 38.38 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.257 175.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.504 ' HA ' HG21 ' A' ' 29' ' ' THR . 58.2 Cg_endo -68.55 137.51 39.43 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.116 2.544 . . . . 0.0 112.203 172.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -52.75 -17.1 1.17 Allowed 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -46.44 56.49 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.342 1.857 . . . . 0.0 112.041 171.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.05 -35.98 28.18 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.581 1.152 . . . . 0.0 112.107 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.5 t -87.26 109.47 25.77 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.757 -1.215 . . . . 0.0 112.08 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.06 150.66 87.64 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.933 2.422 . . . . 0.0 111.509 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -55.05 -18.38 5.22 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -78.74 -33.16 46.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.525 1.53 . . . . 0.0 112.931 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.81 -17.15 23.41 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.52 1.528 . . . . 0.0 112.666 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -51.75 109.48 0.36 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.09 0.956 . . . . 0.0 111.873 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 36.9 mt -86.03 170.54 12.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.915 0.864 . . . . 0.0 111.882 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.3 t -120.13 22.05 11.56 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.961 1.305 . . . . 0.0 112.224 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.51 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 60.4 m-85 -70.29 -19.68 63.08 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 175.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.26 73.04 0.5 Allowed Glycine 0 N--CA 1.471 0.985 0 O-C-N 120.608 -1.308 . . . . 0.0 113.684 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -167.02 30.19 0.19 Allowed Glycine 0 N--CA 1.464 0.507 0 O-C-N 120.407 -1.643 . . . . 0.0 114.163 -176.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 59.9 m -130.55 163.22 27.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.195 0.998 . . . . 0.0 112.109 178.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.0 m -59.08 -31.43 68.88 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.837 1.255 . . . . 0.0 113.198 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.504 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.6 t -144.75 -55.22 0.33 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.605 1.162 . . . . 0.0 111.933 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 29' ' ' THR . 5.3 p -146.27 151.24 14.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-O 122.357 1.075 . . . . 0.0 110.945 174.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 14.2 m -87.83 139.11 30.85 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.233 1.013 . . . . 0.0 108.646 170.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -117.4 136.52 53.12 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.669 0.788 . . . . 0.0 112.042 174.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -78.49 102.77 8.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.849 0.833 . . . . 0.0 111.672 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.9 mt -58.34 -38.2 76.68 Favored 'General case' 0 C--O 1.221 -0.44 0 O-C-N 121.686 -0.634 . . . . 0.0 111.642 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.469 0.488 0 C-N-CA 124.343 1.057 . . . . 0.0 111.819 178.606 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 113.65 0.982 . . . . 0.0 113.65 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -78.83 -27.05 57.43 Favored Glycine 0 CA--C 1.535 1.302 0 O-C-N 121.309 -0.87 . . . . 0.0 114.91 -173.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.78 9.08 12.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.187 2.595 . . . . 0.0 112.713 173.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 83.58 31.21 27.86 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.617 1.58 . . . . 0.0 114.206 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -113.79 179.91 18.93 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.332 1.066 . . . . 0.0 113.112 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -150.52 157.13 42.66 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.807 0.843 . . . . 0.0 111.152 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.0 t -63.5 126.86 28.88 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.046 -1.034 . . . . 0.0 110.807 174.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -124.92 152.89 70.75 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.17 0.988 . . . . 0.0 111.357 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.18 156.76 46.68 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.356 2.037 . . . . 0.0 111.524 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.0 mt -62.52 -24.42 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 178.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -71.8 -19.52 61.99 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.891 1.276 . . . . 0.0 113.747 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -79.24 127.47 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.981 -1.074 . . . . 0.0 110.522 173.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -91.13 117.62 29.76 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.715 0.806 . . . . 0.0 111.498 172.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.66 174.39 10.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.988 176.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 tptt -72.93 124.68 25.92 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.44 -0.788 . . . . 0.0 109.236 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -123.79 142.16 51.36 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 124.808 1.243 . . . . 0.0 110.214 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.75 152.36 19.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.852 0.834 . . . . 0.0 110.355 174.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 mp0 -73.24 -38.6 65.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.389 -0.819 . . . . 0.0 110.648 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.18 58.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.317 0.647 . . . . 0.0 112.638 177.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -82.48 -43.16 17.55 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.909 0.884 . . . . 0.0 111.111 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.2 p -58.25 -31.88 67.82 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.959 -1.713 . . . . 0.0 112.096 178.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.75 -38.24 64.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.975 1.31 . . . . 0.0 113.341 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -57.96 -49.14 77.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.72 1.608 . . . . 0.0 114.107 -176.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 m -75.73 -59.16 2.87 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 169.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 38.8 -143.6 0.3 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 126.077 1.799 . . . . 0.0 112.017 -175.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? 48.23 35.56 5.63 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.02 1.859 . . . . 0.0 116.02 171.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.26 21.19 42.4 Favored Glycine 0 CA--C 1.538 1.486 0 N-CA-C 115.174 0.83 . . . . 0.0 115.174 -172.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -136.78 157.0 47.77 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.342 2.257 . . . . 0.0 111.373 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -134.49 142.17 46.97 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.399 1.88 . . . . 0.0 109.724 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.4 m -86.8 115.45 24.23 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 120.823 -1.173 . . . . 0.0 110.015 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 18.3 m -110.41 152.1 26.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.449 0.642 . . . . 0.0 112.155 176.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.2 p -123.66 143.9 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.601 0.761 . . . . 0.0 110.475 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.5 m95 . . . . . 0 CA--C 1.541 0.633 0 C-N-CA 124.465 1.106 . . . . 0.0 110.939 175.015 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.588 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 86.0 m -51.96 -46.71 64.88 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.514 1.126 . . . . 0.0 111.4 176.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.81 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.799 1.24 . . . . 0.0 112.023 176.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.2 t -67.63 -23.89 65.4 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.242 1.017 . . . . 0.0 112.093 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.444 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.3 OUTLIER -99.32 -2.12 37.19 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 171.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.18 31.92 58.93 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 118.578 -1.124 . . . . 0.0 113.179 -178.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 45.4 m-85 -88.01 166.74 14.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.275 1.43 . . . . 0.0 112.636 174.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.11 129.25 8.01 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 125.021 1.296 . . . . 0.0 110.835 -178.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.4 m -69.16 124.8 24.77 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.066 0.546 . . . . 0.0 111.578 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 mt -131.57 162.73 54.39 Favored Pre-proline 0 CA--C 1.538 0.507 0 O-C-N 124.084 0.865 . . . . 0.0 110.861 174.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.47 138.51 35.73 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 123.003 2.468 . . . . 0.0 110.576 172.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -52.51 -18.38 1.67 Allowed 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.1 t -74.5 -45.33 46.61 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.63 1.972 . . . . 0.0 112.533 171.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -74.99 -43.16 55.51 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.357 1.063 . . . . 0.0 110.971 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.7 t -84.82 119.23 72.48 Favored Pre-proline 0 C--O 1.242 0.698 0 C-N-CA 123.348 0.659 . . . . 0.0 111.906 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.4 148.23 92.86 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.471 2.114 . . . . 0.0 110.869 -178.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -49.98 -28.08 6.33 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 173.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.02 -32.84 67.54 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 174.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.38 -17.87 26.49 Favored 'General case' 0 N--CA 1.46 0.064 0 C-N-CA 125.349 1.46 . . . . 0.0 113.539 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.417 ' HG2' HG21 ' A' ' 30' ' ' VAL . 90.4 mtt180 -51.72 105.91 0.13 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.479 -0.763 . . . . 0.0 111.443 173.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' ' 31' ' ' CYS . 47.3 mt -84.64 167.33 16.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.487 1.137 . . . . 0.0 111.194 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 p -116.59 18.18 15.09 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.822 1.649 . . . . 0.0 112.426 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.588 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 51.2 m-85 -66.93 -9.21 35.81 Favored 'General case' 0 C--O 1.211 -0.921 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.17 57.37 19.5 Favored Glycine 0 N--CA 1.472 1.095 0 O-C-N 120.444 -1.41 . . . . 0.0 113.098 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -147.22 23.55 1.57 Allowed Glycine 0 C--O 1.226 -0.404 0 CA-C-O 118.767 -1.018 . . . . 0.0 115.575 -172.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 58.8 m -141.39 143.6 34.04 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.216 1.006 . . . . 0.0 111.134 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.3 m -50.24 -43.87 53.17 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.837 1.255 . . . . 0.0 113.37 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.52 -73.49 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.508 1.923 . . . . 0.0 110.509 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.417 HG21 ' HG2' ' A' ' 21' ' ' ARG . 9.4 p -148.09 153.8 11.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 123.839 0.856 . . . . 0.0 111.015 177.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 88.1 m -91.53 133.94 35.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.64 138.62 45.73 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.762 1.225 . . . . 0.0 112.038 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -81.4 95.95 7.2 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 122.912 1.339 . . . . 0.0 114.415 178.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.15 -37.31 86.7 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 120.718 -1.239 . . . . 0.0 110.927 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.47 0.544 0 O-C-N 120.008 -1.683 . . . . 0.0 113.263 179.572 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.584 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.95 -37.43 60.57 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.567 1.08 . . . . 0.0 112.226 -178.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -80.28 8.09 8.17 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.099 1.36 . . . . 0.0 113.809 174.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.68 19.27 52.44 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.195 1.379 . . . . 0.0 114.069 -177.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.39 150.26 26.97 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 125.138 1.351 . . . . 0.0 112.77 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -140.55 145.65 37.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 124.657 1.183 . . . . 0.0 110.322 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 91.4 m -71.77 114.3 9.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.522 0.729 . . . . 0.0 111.912 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -117.33 148.72 43.24 Favored Pre-proline 0 C--O 1.241 0.618 0 C-N-CA 124.172 0.989 . . . . 0.0 110.581 -179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.79 152.7 77.22 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 121.86 1.706 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.3 mt -60.61 -18.4 52.87 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.56 -24.27 56.66 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.049 1.739 . . . . 0.0 112.844 171.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -78.26 143.29 37.18 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 119.961 -1.712 . . . . 0.0 110.582 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -102.75 120.72 41.09 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 124.535 1.134 . . . . 0.0 111.371 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.6 p -169.5 173.23 6.57 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.236 1.414 . . . . 0.0 110.943 175.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -76.0 102.26 5.57 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.89 1.276 . . . . 0.0 110.955 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -118.73 139.64 51.23 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.49 1.116 . . . . 0.0 110.342 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 17.8 mt -87.92 126.31 34.98 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 123.106 0.563 . . . . 0.0 110.171 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -60.62 -39.35 87.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.335 0.654 . . . . 0.0 111.816 -178.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.34 -26.57 58.69 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.117 0.967 . . . . 0.0 113.023 175.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -88.67 -22.33 23.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.225 1.01 . . . . 0.0 112.327 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.8 p -54.91 -29.3 55.72 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.968 1.707 . . . . 0.0 112.708 175.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.64 49.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.328 1.451 . . . . 0.0 113.053 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.1 m -55.23 -42.77 73.85 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 174.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 73.8 m -80.37 -36.62 33.72 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.821 0.448 . . . . 0.0 111.678 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 110.36 170.39 19.75 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 122.954 1.308 . . . . 0.0 112.514 179.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -56.26 134.87 53.59 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.749 -1.442 . . . . 0.0 111.092 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.13 5.4 65.85 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.977 -0.902 . . . . 0.0 114.054 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -140.99 163.63 32.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.843 2.057 . . . . 0.0 110.225 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -123.9 162.05 24.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.76 1.624 . . . . 0.0 110.151 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -123.7 97.48 5.4 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.566 0.747 . . . . 0.0 110.95 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 93.8 m -97.72 138.67 34.76 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.338 1.055 . . . . 0.0 110.157 -178.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -105.17 145.76 13.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 124.136 0.974 . . . . 0.0 111.369 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.7 m95 . . . . . 0 C--N 1.327 -0.379 0 CA-C-O 122.139 0.971 . . . . 0.0 110.839 177.621 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -110.13 -33.03 6.79 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.004 0.43 . . . . 0.0 110.575 -175.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -49.6 -58.28 5.55 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.985 0.914 . . . . 0.0 111.477 177.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.63 -31.22 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.322 0.649 . . . . 0.0 112.438 176.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.67 -29.45 69.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.636 1.174 . . . . 0.0 111.318 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 2.1 mmmp? -96.7 -9.53 28.87 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 117.286 -1.34 . . . . 0.0 114.169 174.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 84.25 34.42 17.38 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 125.107 1.504 . . . . 0.0 112.541 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.524 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 59.1 m-85 -87.58 170.53 11.23 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.985 1.314 . . . . 0.0 112.574 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.72 123.9 5.85 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.794 -0.923 . . . . 0.0 110.794 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -74.26 131.59 41.33 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-O 118.799 -0.62 . . . . 0.0 111.252 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 mt -144.72 160.67 46.54 Favored Pre-proline 0 CA--C 1.53 0.199 0 O-C-N 124.075 0.859 . . . . 0.0 111.071 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.624 ' HA ' HG21 ' A' ' 29' ' ' THR . 55.4 Cg_endo -67.07 137.73 45.25 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.484 2.789 . . . . 0.0 110.913 174.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.497 ' HA ' HG11 ' A' ' 30' ' ' VAL . 66.9 mt-30 -52.08 -23.17 4.9 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 175.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 t -70.38 -46.44 64.06 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 124.257 1.023 . . . . 0.0 113.208 171.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -72.85 -41.17 65.06 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.957 0.903 . . . . 0.0 110.197 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.1 t -85.38 124.44 71.69 Favored Pre-proline 0 CA--C 1.541 0.622 0 O-C-N 120.591 -1.318 . . . . 0.0 111.715 -175.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -62.71 145.73 95.05 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.696 2.264 . . . . 0.0 110.494 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -52.87 -21.33 4.14 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -79.72 -34.08 40.35 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.671 1.588 . . . . 0.0 112.62 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.61 -25.14 28.79 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 117.881 -1.056 . . . . 0.0 112.481 177.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -49.18 111.35 0.47 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.176 0.898 . . . . 0.0 110.933 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.7 mt -93.8 174.71 7.04 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.725 0.774 . . . . 0.0 109.879 -179.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 m -115.14 25.24 11.03 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.009 1.324 . . . . 0.0 111.86 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.524 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 52.0 m-85 -67.93 -11.72 59.3 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-O 117.954 -1.022 . . . . 0.0 112.865 175.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 45.0 80.42 0.05 OUTLIER Glycine 0 N--CA 1.473 1.166 0 CA-C-N 120.882 1.673 . . . . 0.0 114.404 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 177.64 27.73 0.04 OUTLIER Glycine 0 C--O 1.226 -0.355 0 O-C-N 120.643 -1.504 . . . . 0.0 113.401 -174.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.7 m -125.89 159.26 33.0 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.762 0.825 . . . . 0.0 110.872 176.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.4 p -43.18 -43.58 4.73 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.463 1.105 . . . . 0.0 112.899 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.624 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.3 t -137.81 -61.82 0.61 Allowed 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.963 1.705 . . . . 0.0 111.311 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.542 ' H ' HG23 ' A' ' 29' ' ' THR . 7.8 p -138.57 151.62 24.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 122.132 0.968 . . . . 0.0 110.387 179.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -90.76 134.1 34.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.26 173.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -108.81 141.26 41.09 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.113 0.965 . . . . 0.0 111.826 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -81.32 103.19 10.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.46 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.4 mt -63.61 -32.71 74.26 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 121.063 -1.023 . . . . 0.0 110.825 176.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.5 t -64.93 -29.61 70.56 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 119.352 -2.093 . . . . 0.0 112.709 176.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -86.67 -36.1 18.94 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.538 0.735 . . . . 0.0 112.924 177.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -88.42 -65.34 1.03 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 124.109 0.964 . . . . 0.0 110.14 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.6 t -173.06 139.52 0.83 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.8 1.24 . . . . 0.0 112.432 -179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -114.05 29.5 7.68 Favored Glycine 0 C--O 1.229 -0.193 0 CA-C-O 117.274 -1.848 . . . . 0.0 112.181 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.5 t -50.95 -38.4 50.28 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 119.028 1.414 . . . . 0.0 110.633 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -72.18 -49.29 36.75 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.033 0.933 . . . . 0.0 112.831 178.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.71 -34.98 79.44 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-O 119.695 -0.503 . . . . 0.0 113.354 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.3 mttp -80.07 14.82 1.7 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.627 1.171 . . . . 0.0 113.781 173.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 71.05 45.15 52.36 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 123.791 0.71 . . . . 0.0 113.265 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -124.43 159.66 19.05 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 125.594 1.568 . . . . 0.0 112.764 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -147.51 153.55 39.65 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 122.676 1.227 . . . . 0.0 111.477 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.2 m -64.34 124.31 21.41 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 120.927 -1.108 . . . . 0.0 112.507 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -122.64 147.97 51.96 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-O 122.019 0.914 . . . . 0.0 111.258 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.23 153.24 71.68 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.212 1.941 . . . . 0.0 110.416 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.641 HD22 ' HE3' ' A' ' 69' ' ' LYS . 21.5 mt -60.08 -22.06 62.25 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 175.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -74.66 -18.59 60.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.015 1.326 . . . . 0.0 112.591 175.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.9 tpp85 -87.27 127.66 35.17 Favored 'General case' 0 C--O 1.224 -0.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.454 176.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.03 119.38 19.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.742 175.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.2 t -165.69 176.05 8.34 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.214 1.006 . . . . 0.0 110.401 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -96.91 110.45 22.96 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.779 1.231 . . . . 0.0 110.466 174.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -111.01 138.12 47.81 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 124.455 1.102 . . . . 0.0 110.727 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 13.2 mt -89.16 153.2 21.14 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.455 -0.778 . . . . 0.0 110.433 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -63.92 -36.28 83.41 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.416 -0.802 . . . . 0.0 112.102 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.91 -30.1 50.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.486 0.714 . . . . 0.0 112.285 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -81.24 -33.61 32.7 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 63.2 m -56.27 -31.46 63.62 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 121.051 -1.031 . . . . 0.0 112.16 177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -40.08 70.11 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.338 1.055 . . . . 0.0 112.746 175.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -48.0 -58.64 4.17 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.423 1.489 . . . . 0.0 111.938 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.7 m -64.36 -49.64 70.86 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.593 177.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.13 -169.68 12.97 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-O 123.097 1.387 . . . . 0.0 112.759 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -64.94 136.74 57.18 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.713 -1.463 . . . . 0.0 111.73 177.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.05 5.33 89.33 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 119.328 -0.707 . . . . 0.0 113.56 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -136.89 161.14 36.82 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.734 1.214 . . . . 0.0 110.951 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.641 ' HE3' HD22 ' A' ' 50' ' ' LEU . 43.9 mttt -138.47 121.4 16.61 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.759 1.224 . . . . 0.0 110.659 -178.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.6 t -73.8 106.92 5.74 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.7 -0.625 . . . . 0.0 111.048 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.457 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.9 OUTLIER -91.21 151.84 20.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.402 0.62 . . . . 0.0 110.662 177.153 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.6 p -127.75 145.48 34.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 124.209 1.003 . . . . 0.0 110.601 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.457 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 47.2 m95 -113.72 179.91 3.82 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 121.569 0.699 . . . . 0.0 111.51 175.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.68 HD23 ' H ' ' A' ' 74' ' ' LEU . 1.6 pt? -76.39 34.69 0.14 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 174.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 116.578 -1.677 . . . . 0.0 111.809 -179.722 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 118.973 -0.537 . . . . 0.0 109.687 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -106.72 -30.74 8.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.732 -171.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.554 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 63.3 m -51.5 -56.61 12.44 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.743 1.217 . . . . 0.0 110.201 176.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.18 -32.06 33.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 124.532 1.133 . . . . 0.0 113.827 174.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.5 t -61.23 -33.73 73.97 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.063 1.345 . . . . 0.0 111.37 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -96.03 -5.82 40.17 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 82.61 30.06 34.0 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-O 117.695 -1.614 . . . . 0.0 113.347 -177.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -75.11 168.66 19.56 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.458 1.629 . . . . 0.0 112.936 174.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.81 114.63 3.17 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.293 1.425 . . . . 0.0 111.435 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.5 m -66.04 131.45 46.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 117.989 -1.005 . . . . 0.0 111.748 172.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.418 ' O ' HG13 ' A' ' 30' ' ' VAL . 51.8 mt -145.11 155.63 54.87 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 124.04 0.838 . . . . 0.0 111.496 176.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.499 ' HA ' HG21 ' A' ' 29' ' ' THR . 58.2 Cg_endo -63.43 138.27 64.66 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.509 2.139 . . . . 0.0 110.587 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -25.55 1.99 Allowed 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 p -71.09 -41.17 70.98 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.998 0.919 . . . . 0.0 112.921 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -78.91 -46.22 18.92 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.822 1.649 . . . . 0.0 111.567 176.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.3 t -88.08 121.67 70.41 Favored Pre-proline 0 C--O 1.244 0.799 0 C-N-CA 124.142 0.977 . . . . 0.0 111.485 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -61.47 144.5 98.06 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.74 2.293 . . . . 0.0 110.5 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.2 pp0? -47.38 -30.12 3.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.214 1.006 . . . . 0.0 113.688 175.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -69.7 -32.97 71.87 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.962 1.305 . . . . 0.0 113.739 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.67 -20.42 21.62 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.749 1.22 . . . . 0.0 112.506 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.518 ' HG2' HG21 ' A' ' 30' ' ' VAL . 73.5 mtt180 -51.1 100.34 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.907 0.883 . . . . 0.0 112.272 173.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 41.9 mt -84.28 166.41 17.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.967 0.889 . . . . 0.0 111.214 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -113.79 29.3 8.1 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.184 1.794 . . . . 0.0 112.277 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.554 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 15.2 m-85 -68.17 -17.95 64.48 Favored 'General case' 0 C--O 1.211 -0.944 0 O-C-N 121.255 -0.903 . . . . 0.0 112.57 175.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.1 74.38 0.41 Allowed Glycine 0 N--CA 1.473 1.11 0 CA-C-O 123.767 1.759 . . . . 0.0 113.29 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.73 36.54 0.07 OUTLIER Glycine 0 C--O 1.224 -0.47 0 O-C-N 120.691 -1.476 . . . . 0.0 112.299 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 53.3 m -134.75 160.95 36.57 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 117.012 0.406 . . . . 0.0 111.545 170.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.8 m -54.68 -37.61 65.98 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.121 0.969 . . . . 0.0 112.966 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -135.44 -56.34 0.79 Allowed 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.279 1.432 . . . . 0.0 110.382 -179.474 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.518 HG21 ' HG2' ' A' ' 21' ' ' ARG . 2.4 p -152.76 145.49 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.992 0.917 . . . . 0.0 111.898 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 61.2 m -86.2 134.33 33.79 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.091 172.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -105.62 146.59 29.48 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 124.108 0.963 . . . . 0.0 110.962 172.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -86.21 107.35 17.86 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.723 0.809 . . . . 0.0 112.05 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.9 mt -62.34 -29.56 70.54 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.469 -0.77 . . . . 0.0 111.704 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.4 m -72.29 -18.31 61.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 119.818 -1.801 . . . . 0.0 113.087 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.9 mmtt -96.46 -38.06 10.17 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.637 1.175 . . . . 0.0 111.878 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 37' ' ' LEU . 2.7 mm? -87.82 -68.87 0.73 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.351 1.06 . . . . 0.0 110.33 177.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.422 HG21 ' OE2' ' A' ' 60' ' ' GLU . 14.9 t -166.6 136.63 3.17 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 123.599 1.666 . . . . 0.0 112.769 -174.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -102.45 24.52 30.69 Favored Glycine 0 C--O 1.222 -0.605 0 CA-C-O 116.177 -2.457 . . . . 0.0 113.965 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 5.4 t -46.85 -62.99 1.14 Allowed 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 121.27 2.535 . . . . 0.0 111.006 -172.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -33.37 52.76 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 174.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.18 65.92 Favored Glycine 0 CA--C 1.535 1.31 0 CA-C-N 118.261 0.482 . . . . 0.0 113.836 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.7 mmpt? -88.75 12.27 15.41 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.015 1.726 . . . . 0.0 113.52 173.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 82.47 40.47 9.92 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 124.691 1.139 . . . . 0.0 112.411 -176.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.14 165.02 31.33 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 121.566 0.537 . . . . 0.0 113.578 174.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -146.93 154.61 41.48 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.912 1.285 . . . . 0.0 112.081 -176.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.0 t -73.28 127.14 31.79 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 120.716 -1.24 . . . . 0.0 110.604 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -126.33 149.93 68.66 Favored Pre-proline 0 CA--C 1.543 0.695 0 C-N-CA 123.607 0.763 . . . . 0.0 111.074 -178.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.28 158.91 55.51 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.524 2.15 . . . . 0.0 111.744 176.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.421 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 16.0 mt -61.71 -19.79 62.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.525 0.73 . . . . 0.0 112.935 176.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -80.99 -15.41 56.29 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 127.004 2.122 . . . . 0.0 112.618 175.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -87.12 137.33 32.44 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 120.962 -1.087 . . . . 0.0 109.718 174.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -87.6 120.41 28.89 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.793 1.237 . . . . 0.0 111.075 172.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.13 -177.91 5.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.003 0.921 . . . . 0.0 110.361 174.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -87.62 112.51 22.39 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 121.357 -0.839 . . . . 0.0 110.404 170.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.28 133.03 50.21 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.308 1.443 . . . . 0.0 113.02 177.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mt -87.52 154.77 20.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 120.435 -1.416 . . . . 0.0 110.265 177.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -68.3 -36.79 79.87 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.92 -37.56 67.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.062 0.545 . . . . 0.0 110.993 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.422 ' OE2' HG21 ' A' ' 38' ' ' THR . 23.8 mm-40 -75.99 -30.5 58.58 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -177.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.1 t -49.08 -44.77 42.29 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.273 0.629 . . . . 0.0 112.179 171.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.62 -38.75 72.51 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 118.511 -0.757 . . . . 0.0 112.978 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.6 t -51.11 -44.75 61.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.527 1.531 . . . . 0.0 112.725 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.8 m -68.4 -60.29 2.55 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.409 0.684 . . . . 0.0 112.152 172.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 136.55 -156.73 23.26 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 122.387 0.993 . . . . 0.0 113.816 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -80.88 133.14 35.52 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.762 -1.434 . . . . 0.0 111.574 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.24 10.0 84.29 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 123.916 0.77 . . . . 0.0 114.381 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -137.56 155.14 49.56 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.013 1.325 . . . . 0.0 109.948 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 19.3 mmtp -136.26 131.04 33.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 126.503 1.921 . . . . 0.0 109.437 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.4 t -73.56 111.04 8.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 119.061 -0.495 . . . . 0.0 110.404 175.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 40.5 m -106.21 161.29 14.65 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 121.557 0.694 . . . . 0.0 111.724 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p -129.59 144.16 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 123.556 0.743 . . . . 0.0 111.121 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -101.53 -178.73 3.81 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 122.484 1.135 . . . . 0.0 111.008 174.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.7 mp -57.69 110.83 0.96 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.094 0.957 . . . . 0.0 108.955 168.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.264 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 171.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.483 1.188 0 CA-C-O 119.035 -0.507 . . . . 0.0 109.886 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -121.69 -41.3 2.48 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.809 0.338 . . . . 0.0 111.34 -172.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.634 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 87.4 m -50.83 -51.26 52.85 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.093 -1.004 . . . . 0.0 111.109 177.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -59.33 -32.35 48.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 124.202 1.001 . . . . 0.0 113.302 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.4 t -67.04 -29.07 68.77 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.66 1.584 . . . . 0.0 111.309 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.434 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 35.1 mmtt -94.31 -5.59 46.32 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 172.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.08 37.22 25.74 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-O 118.293 -1.282 . . . . 0.0 112.947 -177.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.43 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 43.1 m-85 -98.87 161.53 13.58 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.636 1.975 . . . . 0.0 112.216 174.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.72 130.49 9.12 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.303 0.954 . . . . 0.0 111.528 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.3 134.2 48.83 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 118.105 -0.95 . . . . 0.0 111.939 173.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.2 mt -145.39 156.15 53.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 O-C-N 123.741 0.651 . . . . 0.0 110.986 175.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -66.81 140.08 54.34 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 122.377 2.052 . . . . 0.0 110.4 174.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -49.4 -23.58 1.57 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 174.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 p -70.78 -44.48 66.57 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.651 1.18 . . . . 0.0 112.698 173.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -79.67 -42.22 25.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.923 1.689 . . . . 0.0 111.766 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.5 t -89.73 122.22 68.28 Favored Pre-proline 0 C--O 1.245 0.865 0 C-N-CA 124.525 1.13 . . . . 0.0 111.847 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.18 146.73 94.27 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.866 2.377 . . . . 0.0 110.85 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -51.39 -29.08 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 175.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -70.2 -24.65 63.16 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.67 -17.53 17.73 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 126.446 1.899 . . . . 0.0 113.984 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.506 ' HG2' HG21 ' A' ' 30' ' ' VAL . 85.4 mtt180 -57.11 101.33 0.06 Allowed 'General case' 0 N--CA 1.463 0.186 0 O-C-N 121.307 -0.871 . . . . 0.0 111.113 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 33' ' ' ASP . 53.8 mt -85.21 168.12 15.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 122.406 1.098 . . . . 0.0 110.815 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -120.59 30.6 6.84 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.428 1.891 . . . . 0.0 112.403 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.634 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 38.6 m-85 -67.46 -16.48 64.24 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 121.535 -0.728 . . . . 0.0 112.667 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.07 67.07 2.14 Favored Glycine 0 N--CA 1.469 0.897 0 CA-C-N 119.825 1.193 . . . . 0.0 112.831 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -164.34 25.24 0.18 Allowed Glycine 0 N--CA 1.462 0.426 0 O-C-N 120.983 -1.304 . . . . 0.0 114.276 -177.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 55.4 m -132.39 151.03 52.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.866 0.866 . . . . 0.0 111.541 175.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.9 m -53.36 -41.82 66.21 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.191 0.997 . . . . 0.0 112.941 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.0 -72.64 0.68 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.993 1.717 . . . . 0.0 109.581 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.506 HG21 ' HG2' ' A' ' 21' ' ' ARG . 3.3 p -143.97 140.62 25.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.413 1.085 . . . . 0.0 111.227 -177.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.558 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 97.4 m -79.8 137.89 37.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.043 -1.036 . . . . 0.0 109.477 172.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.66 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -110.67 133.22 53.52 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.349 1.06 . . . . 0.0 111.766 172.015 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.658 ' HB3' HD11 ' A' ' 22' ' ' LEU . 1.1 p30 -80.27 97.22 6.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 123.436 1.589 . . . . 0.0 113.937 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.1 mt -59.24 -41.26 88.29 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 119.785 -1.822 . . . . 0.0 110.955 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.3 m -62.76 -34.56 77.47 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 mtpt -80.86 -38.51 28.01 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 118.017 -0.992 . . . . 0.0 112.164 176.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.66 HD11 ' SG ' ' A' ' 32' ' ' CYS . 46.0 mt -60.91 -61.37 2.63 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 124.334 1.054 . . . . 0.0 111.15 176.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.4 t -159.62 143.18 14.47 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 122.561 1.172 . . . . 0.0 110.891 -178.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -70.99 23.98 0.54 Allowed Glycine 0 CA--C 1.531 1.065 0 CA-C-O 115.697 -2.724 . . . . 0.0 115.282 176.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.4 t -42.75 -66.43 0.37 Allowed 'General case' 0 N--CA 1.48 1.038 0 CA-C-N 121.611 2.705 . . . . 0.0 111.394 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.68 -36.68 50.99 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 176.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.74 -27.98 69.24 Favored Glycine 0 CA--C 1.534 1.245 0 CA-C-O 119.358 -0.69 . . . . 0.0 112.978 -178.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -86.27 13.25 8.32 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.391 2.276 . . . . 0.0 113.318 173.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.34 37.16 54.53 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-N 118.252 0.478 . . . . 0.0 113.055 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -108.14 162.18 13.19 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 125.639 1.59 . . . . 0.0 113.466 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -142.95 150.12 39.29 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 124.756 1.222 . . . . 0.0 109.894 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 96.5 m -61.89 114.46 3.37 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.388 -0.82 . . . . 0.0 111.8 174.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -116.14 148.23 41.06 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 124.521 1.128 . . . . 0.0 111.015 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -67.48 152.26 78.85 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.774 2.316 . . . . 0.0 111.186 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 52.5 mt -60.75 -20.92 62.38 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 174.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -74.98 -20.26 59.74 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.528 1.531 . . . . 0.0 112.468 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -86.03 128.17 34.81 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 120.781 -1.199 . . . . 0.0 109.959 176.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.82 118.87 23.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.493 0.717 . . . . 0.0 110.926 174.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.19 173.86 11.89 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.516 1.126 . . . . 0.0 110.354 176.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.3 ttmt -82.33 114.32 20.72 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.84 129.77 51.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.608 1.563 . . . . 0.0 112.316 177.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 21.9 tp -85.47 136.08 33.58 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 120.642 -1.286 . . . . 0.0 110.067 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -54.12 -38.1 65.06 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 120.695 -1.253 . . . . 0.0 113.982 172.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.48 -33.53 74.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.025 0.93 . . . . 0.0 110.546 177.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -79.32 -33.02 43.51 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.232 1.013 . . . . 0.0 112.206 178.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.41 ' CB ' ' HD3' ' A' ' 69' ' ' LYS . 24.7 p -55.07 -28.86 55.54 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.224 1.01 . . . . 0.0 113.477 176.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.84 -35.26 77.73 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.404 1.082 . . . . 0.0 112.851 174.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.8 t -56.48 -45.54 80.88 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.877 1.271 . . . . 0.0 112.179 178.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 66.6 m -74.91 -43.11 56.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.299 0.64 . . . . 0.0 112.512 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 114.93 -146.75 18.86 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 122.414 1.008 . . . . 0.0 112.586 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -87.62 147.04 25.46 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.116 -1.226 . . . . 0.0 111.947 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.87 6.92 74.25 Favored Glycine 0 CA--C 1.538 1.51 0 N-CA-C 114.272 0.469 . . . . 0.0 114.272 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.8 mm-40 -138.51 153.45 48.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.486 1.514 . . . . 0.0 109.754 -178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.41 ' HD3' ' CB ' ' A' ' 61' ' ' SER . 14.8 mmtp -134.14 125.49 28.02 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 126.252 1.821 . . . . 0.0 110.179 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.56 107.81 7.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 118.988 -0.529 . . . . 0.0 110.584 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 24.9 m -98.4 157.5 16.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 123.147 0.579 . . . . 0.0 111.94 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.1 t -106.0 138.08 33.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 110.9 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.6 m95 -104.97 -56.96 2.09 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 114.881 1.438 . . . . 0.0 114.881 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.2 mp -52.03 122.71 8.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.491 0.717 . . . . 0.0 109.496 175.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 42.0 m80 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 116.3 -1.809 . . . . 0.0 111.205 177.814 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -111.58 -29.65 7.66 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.436 0.636 . . . . 0.0 110.56 -177.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.1 m -54.82 -58.77 6.23 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.303 -0.873 . . . . 0.0 111.348 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.2 p -58.01 -33.46 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.297 0.481 . . . . 0.0 112.297 177.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 m -63.12 -28.57 70.16 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.217 1.007 . . . . 0.0 111.077 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.4 mmmp? -96.57 -10.59 26.89 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 173.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.52 36.73 7.86 Favored Glycine 0 CA--C 1.52 0.404 0 CA-C-O 118.488 -1.173 . . . . 0.0 112.097 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -97.41 165.44 12.01 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.763 1.282 . . . . 0.0 111.786 176.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.86 131.69 10.09 Favored Glycine 0 CA--C 1.522 0.489 0 N-CA-C 111.273 -0.731 . . . . 0.0 111.273 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.8 m -79.4 123.74 27.79 Favored 'General case' 0 CA--C 1.512 -0.49 0 O-C-N 122.085 -0.656 . . . . 0.0 110.791 176.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.474 ' O ' HG12 ' A' ' 30' ' ' VAL . 31.9 mt -138.62 155.01 73.7 Favored Pre-proline 0 C--O 1.218 -0.602 0 CA-C-O 117.8 -1.095 . . . . 0.0 111.725 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -63.77 139.79 70.7 Favored 'Trans proline' 0 C--O 1.219 -0.44 0 C-N-CA 124.333 3.355 . . . . 0.0 110.488 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.443 ' HA ' HG11 ' A' ' 30' ' ' VAL . 28.3 mp0 -51.62 -26.98 9.95 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 176.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 m -65.57 -46.81 78.05 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 123.893 0.877 . . . . 0.0 113.155 170.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -75.97 -36.59 59.2 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.509 0.723 . . . . 0.0 112.227 176.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.4 t -89.24 121.37 69.52 Favored Pre-proline 0 C--O 1.241 0.632 0 O-C-N 121.089 -1.007 . . . . 0.0 111.823 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -62.96 146.96 95.03 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.651 2.234 . . . . 0.0 110.545 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -52.05 -19.72 2.04 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.91 -32.54 27.21 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.637 1.175 . . . . 0.0 113.052 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.81 -20.58 25.89 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 118.035 -0.983 . . . . 0.0 112.078 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HD3' HG21 ' A' ' 30' ' ' VAL . 60.0 mtt180 -55.24 119.27 5.28 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.429 0.692 . . . . 0.0 110.078 175.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.0 mt -102.71 175.92 5.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.791 0.805 . . . . 0.0 110.272 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.3 29.85 7.55 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.26 1.024 . . . . 0.0 111.593 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -67.93 -18.36 64.74 Favored 'General case' 0 C--O 1.212 -0.92 0 O-C-N 121.341 -0.849 . . . . 0.0 111.914 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.89 49.97 67.26 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 120.734 -1.229 . . . . 0.0 112.441 178.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -142.7 33.65 1.85 Allowed Glycine 0 C--O 1.225 -0.458 0 CA-C-O 118.032 -1.427 . . . . 0.0 113.5 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -142.44 150.54 40.72 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.107 0.963 . . . . 0.0 111.777 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.1 m -58.67 -45.56 89.12 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 123.765 0.666 . . . . 0.0 111.416 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 58.4 p -105.66 -75.79 0.62 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 123.222 0.609 . . . . 0.0 109.594 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.572 HG21 ' HD3' ' A' ' 21' ' ' ARG . 7.7 p -148.16 148.0 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 C-N-CA 126.014 1.726 . . . . 0.0 110.49 179.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.8 t -79.85 131.34 35.85 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.127 -0.983 . . . . 0.0 110.891 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.22 139.11 45.73 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.384 1.074 . . . . 0.0 111.737 176.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -81.09 101.2 9.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.808 179.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.47 -19.42 64.72 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-O 117.961 -1.019 . . . . 0.0 112.246 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.0 t -68.69 -38.16 80.1 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 120.105 1.32 . . . . 0.0 112.336 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.1 mtmt -88.39 -36.56 16.48 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 122.792 0.437 . . . . 0.0 112.014 177.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 37' ' ' LEU . 1.9 mm? -71.87 -47.88 49.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 C-N-CA 123.086 0.554 . . . . 0.0 111.628 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 79.0 p -130.64 -175.02 3.52 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 122.442 1.115 . . . . 0.0 111.076 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -125.56 -41.42 0.35 Allowed Glycine 0 C--O 1.221 -0.682 0 CA-C-O 118.057 -1.413 . . . . 0.0 112.369 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.7 t -44.86 -50.38 10.38 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.536 1.168 . . . . 0.0 111.709 -177.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -64.06 -47.47 80.04 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 123.84 0.856 . . . . 0.0 112.99 176.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.1 -39.3 63.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 123.889 0.757 . . . . 0.0 113.083 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.0 mttm -79.31 11.92 2.66 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.444 1.098 . . . . 0.0 113.487 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.8 39.43 96.76 Favored Glycine 0 CA--C 1.528 0.904 0 C-N-CA 124.171 0.891 . . . . 0.0 112.292 -177.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -85.69 172.17 46.07 Favored Glycine 0 CA--C 1.524 0.627 0 CA-C-O 121.954 0.752 . . . . 0.0 112.376 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -136.16 150.1 48.91 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 123.012 1.386 . . . . 0.0 112.434 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.5 t -79.17 135.69 36.88 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 120.753 -1.217 . . . . 0.0 111.662 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -133.28 148.06 67.51 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 124.061 0.944 . . . . 0.0 111.23 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.94 159.13 54.29 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.657 2.238 . . . . 0.0 110.896 177.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.421 HD11 ' HA2' ' A' ' 67' ' ' GLY . 28.7 mt -61.92 -16.73 53.08 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 175.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -84.61 -13.51 51.42 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 123.617 1.675 . . . . 0.0 111.963 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -92.83 130.59 38.39 Favored 'General case' 0 C--O 1.223 -0.313 0 O-C-N 118.783 -2.448 . . . . 0.0 110.246 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -85.12 121.55 28.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.333 176.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.496 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 1.8 t -162.1 176.44 10.69 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 123.903 0.881 . . . . 0.0 110.688 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.3 ttmt -94.87 108.25 20.28 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.04 0.936 . . . . 0.0 111.611 175.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.83 132.04 53.38 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.766 1.226 . . . . 0.0 111.094 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 58' ' ' GLN . 15.6 tp -77.69 137.7 38.65 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.009 -1.057 . . . . 0.0 109.593 176.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.439 ' N ' HD12 ' A' ' 57' ' ' LEU . 5.9 pt20 -53.34 -40.15 64.67 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 120.754 -1.216 . . . . 0.0 113.521 173.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.66 -24.19 63.58 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.878 0.871 . . . . 0.0 111.828 176.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -88.98 -31.06 18.31 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.467 1.107 . . . . 0.0 112.596 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 51.6 p -53.83 -28.04 33.28 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.828 1.251 . . . . 0.0 112.024 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.46 74.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.391 1.076 . . . . 0.0 112.332 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 m -56.93 -56.94 15.18 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.862 1.265 . . . . 0.0 111.307 178.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 52.8 m -60.33 -43.78 96.1 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 176.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.02 171.74 19.49 Favored Glycine 0 CA--C 1.523 0.562 0 CA-C-O 122.917 1.287 . . . . 0.0 112.271 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -56.58 135.41 54.71 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.464 -1.021 . . . . 0.0 110.764 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.421 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 86.28 9.87 75.45 Favored Glycine 0 CA--C 1.528 0.866 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.852 -179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -144.56 169.05 18.71 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.981 1.312 . . . . 0.0 110.795 177.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -131.77 156.62 45.66 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.558 1.543 . . . . 0.0 110.878 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.9 t -121.3 95.23 4.6 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.218 0.607 . . . . 0.0 111.545 -178.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 34.1 t -83.65 162.95 20.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -115.34 144.66 22.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 124.621 1.168 . . . . 0.0 111.213 174.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.496 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 33.3 m95 -112.85 178.3 4.33 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 122.28 1.038 . . . . 0.0 112.586 173.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 74' ' ' LEU . 4.1 mm? -60.85 167.41 2.83 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.011 173.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 16.0 p80 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 114.698 -2.572 . . . . 0.0 115.148 174.718 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . 0.608 ' ND2' HG12 ' A' ' 4' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.471 0.621 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -135.23 -22.66 1.53 Allowed 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 122.064 0.935 . . . . 0.0 109.997 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.509 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 61.5 m -57.38 -55.27 36.93 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 120.546 -1.346 . . . . 0.0 110.83 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.608 HG12 ' ND2' ' A' ' 1' ' ' ASN . 1.0 OUTLIER -59.31 -29.65 42.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 122.606 0.363 . . . . 0.0 111.913 177.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -70.44 -27.88 64.59 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.687 0.795 . . . . 0.0 111.119 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 22.4 mmmt -95.5 -3.64 46.32 Favored 'General case' 0 C--N 1.338 0.106 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 175.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.7 42.25 11.64 Favored Glycine 0 C--O 1.225 -0.463 0 O-C-N 124.348 1.03 . . . . 0.0 111.323 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.496 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 38.3 m-85 -106.36 162.31 13.8 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 124.254 1.021 . . . . 0.0 111.581 176.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.49 140.68 16.21 Favored Glycine 0 CA--C 1.524 0.614 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.879 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.9 m -79.97 117.11 20.52 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 122.885 0.474 . . . . 0.0 111.398 177.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.502 ' O ' HG12 ' A' ' 30' ' ' VAL . 53.2 mt -132.35 154.43 81.59 Favored Pre-proline 0 C--O 1.214 -0.791 0 O-C-N 123.576 0.547 . . . . 0.0 111.722 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -64.54 140.96 71.44 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 123.794 2.996 . . . . 0.0 110.622 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.525 ' HA ' HG11 ' A' ' 30' ' ' VAL . 65.3 mt-30 -51.2 -25.48 5.53 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 177.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 91.3 p -68.8 -46.91 67.43 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 171.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.439 ' OD2' HD22 ' A' ' 11' ' ' LEU . 28.5 t0 -72.64 -34.51 67.34 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.886 0.874 . . . . 0.0 111.911 176.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.6 t -92.84 126.65 50.82 Favored Pre-proline 0 CA--C 1.539 0.55 0 O-C-N 120.884 -1.135 . . . . 0.0 111.917 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -63.82 147.36 92.32 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.609 2.206 . . . . 0.0 110.671 178.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -19.53 3.71 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 172.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -81.73 -31.82 31.85 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 123.893 0.877 . . . . 0.0 112.197 175.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.89 -24.62 23.59 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -45.97 117.56 1.56 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.619 0.768 . . . . 0.0 110.376 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.4 HD11 ' HB3' ' A' ' 33' ' ' ASP . 51.7 mt -103.22 174.61 5.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.337 1.065 . . . . 0.0 109.995 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -128.1 31.46 5.07 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.732 0.813 . . . . 0.0 111.177 178.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.509 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 33.0 m-85 -69.0 -17.53 63.93 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 121.226 -0.921 . . . . 0.0 112.065 177.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 64.36 88.03 0.05 OUTLIER Glycine 0 CA--C 1.532 1.104 0 CA-C-O 124.51 2.172 . . . . 0.0 111.857 178.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.24 25.97 0.03 OUTLIER Glycine 0 C--O 1.224 -0.506 0 O-C-N 119.909 -1.936 . . . . 0.0 113.652 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 67.7 m -137.24 149.79 47.4 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 123.415 0.686 . . . . 0.0 111.454 177.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -61.86 -42.6 99.24 Favored 'General case' 0 C--O 1.222 -0.371 0 O-C-N 124.364 1.04 . . . . 0.0 111.291 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 33.5 p -107.67 -75.19 0.64 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.395 0.678 . . . . 0.0 110.245 -178.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.525 HG11 ' HA ' ' A' ' 13' ' ' GLN . 8.4 p -151.05 143.6 16.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 122.919 1.343 . . . . 0.0 111.06 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 91.9 m -82.0 124.17 29.55 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 120.279 -1.513 . . . . 0.0 110.259 173.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.89 142.99 33.44 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 122.315 1.055 . . . . 0.0 111.407 174.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.468 ' HA ' ' CD1' ' A' ' 8' ' ' PHE . 1.9 p30 -81.03 100.71 9.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 124.247 1.975 . . . . 0.0 113.731 177.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.435 HD22 ' CD ' ' A' ' 41' ' ' LYS . 8.8 mt -65.89 -27.84 68.5 Favored 'General case' 0 C--O 1.218 -0.557 0 O-C-N 118.733 -2.479 . . . . 0.0 111.723 -178.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.1 t -70.54 -24.26 62.77 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.3 1.04 . . . . 0.0 112.888 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -96.2 -34.39 11.67 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.469 0.708 . . . . 0.0 110.403 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.436 HD13 ' HA ' ' A' ' 37' ' ' LEU . 2.2 mm? -67.59 -56.73 8.29 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 62.0 p -146.97 -176.55 5.25 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 122.184 0.992 . . . . 0.0 112.1 -177.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -101.91 -42.42 2.27 Favored Glycine 0 C--O 1.219 -0.814 0 CA-C-O 117.993 -1.448 . . . . 0.0 112.154 177.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 49.4 t -41.9 -52.7 4.01 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.987 1.393 . . . . 0.0 112.377 -177.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.435 ' CD ' HD22 ' A' ' 34' ' ' LEU . 74.3 mttt -83.13 -37.6 23.53 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.777 175.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.41 -34.22 33.71 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.524 0.583 . . . . 0.0 113.958 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.6 mmtt -85.68 15.28 4.82 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.198 1.399 . . . . 0.0 113.024 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.72 36.89 93.93 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 123.735 0.683 . . . . 0.0 112.243 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.82 177.49 21.88 Favored Glycine 0 CA--C 1.526 0.76 0 CA-C-O 121.876 0.709 . . . . 0.0 112.192 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -142.28 152.77 43.33 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.7 1.238 . . . . 0.0 111.819 178.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.9 t -66.49 128.77 37.5 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 111.948 175.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -125.23 148.0 59.23 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 122.284 1.04 . . . . 0.0 111.793 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.04 156.23 65.86 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.287 1.992 . . . . 0.0 111.147 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.44 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 9.7 mt -65.16 -18.07 65.0 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 176.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -85.4 -9.6 57.33 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.402 0.681 . . . . 0.0 112.09 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.1 tpp180 -93.36 131.21 38.73 Favored 'General case' 0 C--O 1.224 -0.25 0 O-C-N 120.871 -1.143 . . . . 0.0 110.052 176.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -78.8 121.71 25.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.454 -0.793 . . . . 0.0 111.27 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 12.4 t -168.34 174.56 6.93 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 123.916 0.886 . . . . 0.0 110.055 176.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -92.51 124.45 36.55 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.458 1.103 . . . . 0.0 111.127 173.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -125.91 131.8 52.25 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 125.686 1.594 . . . . 0.0 110.687 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 58' ' ' GLN . 12.3 tp -91.21 135.22 33.94 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 121.562 -0.711 . . . . 0.0 109.808 177.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.439 ' N ' HD12 ' A' ' 57' ' ' LEU . 7.0 pt20 -51.0 -40.25 57.7 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 175.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.01 64.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.142 0.977 . . . . 0.0 111.863 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.402 ' OE1' HD23 ' A' ' 57' ' ' LEU . 1.3 mp0 -95.93 -33.53 12.15 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.67 1.188 . . . . 0.0 110.428 -178.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.1 m -53.53 -30.6 42.46 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.185 0.994 . . . . 0.0 111.37 177.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.58 -32.87 63.42 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.82 0.848 . . . . 0.0 112.937 174.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.5 t -58.01 -58.05 10.11 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 123.705 0.802 . . . . 0.0 111.378 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 97.9 m -71.69 -47.25 55.42 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.964 0.412 . . . . 0.0 111.559 179.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -150.51 18.51 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-O 123.36 1.533 . . . . 0.0 112.38 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -78.29 145.52 35.33 Favored 'General case' 0 C--O 1.217 -0.631 0 O-C-N 120.249 -1.736 . . . . 0.0 111.354 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.71 0.63 85.16 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 119.31 -0.717 . . . . 0.0 113.544 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -149.21 149.31 30.77 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.219 1.007 . . . . 0.0 110.713 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.44 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -132.09 138.86 48.3 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.472 0.709 . . . . 0.0 110.29 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.5 t -77.59 131.45 37.83 Favored 'General case' 0 C--O 1.213 -0.817 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.877 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.515 ' SG ' ' CZ2' ' A' ' 73' ' ' TRP . 0.1 OUTLIER -120.25 150.62 40.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 119.676 1.125 . . . . 0.0 110.386 177.333 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -128.41 141.31 46.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 123.555 0.742 . . . . 0.0 110.308 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.515 ' CZ2' ' SG ' ' A' ' 71' ' ' CYS . 11.7 m95 -109.67 174.4 5.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 122.023 0.916 . . . . 0.0 111.975 175.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.443 HD12 ' OXT' ' A' ' 75' ' ' HIS . 4.0 pp -77.65 141.89 39.17 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.114 174.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.443 ' OXT' HD12 ' A' ' 74' ' ' LEU . 57.2 t-80 . . . . . 0 CA--C 1.554 1.1 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 N--CA 1.485 1.287 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -94.47 -36.75 11.74 Favored 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.462 0.476 . . . . 0.0 111.457 -174.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.7 m -51.97 -55.97 17.12 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 121.136 -0.977 . . . . 0.0 111.136 177.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.6 p -56.93 -34.73 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 175.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.0 t -63.02 -27.17 69.23 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.068 1.347 . . . . 0.0 112.409 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.407 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 1.0 OUTLIER -96.74 -9.7 28.39 Favored 'General case' 0 C--N 1.34 0.176 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 171.299 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 85.89 29.66 25.49 Favored Glycine 0 CA--C 1.525 0.668 0 CA-C-O 117.826 -1.541 . . . . 0.0 112.989 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.407 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 66.5 m-85 -88.81 168.88 12.09 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.065 1.433 . . . . 0.0 113.194 175.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.42 129.79 8.64 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.494 1.045 . . . . 0.0 111.623 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.2 m -77.16 132.4 38.78 Favored 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 118.278 -0.868 . . . . 0.0 111.053 176.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.3 mt -142.59 162.68 43.2 Favored Pre-proline 0 N--CA 1.469 0.513 0 O-C-N 124.327 1.017 . . . . 0.0 111.152 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -70.48 140.92 41.06 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.536 2.157 . . . . 0.0 111.127 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -55.4 -20.86 13.39 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.1 t -67.63 -48.47 66.64 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.902 1.281 . . . . 0.0 113.444 169.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -73.58 -44.68 56.7 Favored 'General case' 0 CA--C 1.553 1.067 0 CA-C-O 123.173 1.463 . . . . 0.0 112.18 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.8 t -79.34 116.63 61.94 Favored Pre-proline 0 CA--C 1.548 0.889 0 O-C-N 119.851 -1.78 . . . . 0.0 112.874 -178.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.67 154.12 71.08 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.012 1.808 . . . . 0.0 111.918 -177.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -28.4 22.22 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.1 pm0 -81.68 -18.96 42.67 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.624 1.97 . . . . 0.0 113.114 178.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.71 -21.72 17.42 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 116.206 -1.854 . . . . 0.0 113.098 172.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -54.91 111.78 0.9 Allowed 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.192 1.36 . . . . 0.0 111.335 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.589 HD21 ' HB2' ' A' ' 33' ' ' ASP . 2.6 mt -94.8 174.61 7.02 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.713 0.768 . . . . 0.0 109.921 -178.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.2 m -118.24 25.49 10.28 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.921 1.288 . . . . 0.0 112.675 178.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -66.03 -20.81 66.3 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-O 117.701 -1.143 . . . . 0.0 112.151 174.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.9 73.25 0.45 Allowed Glycine 0 N--CA 1.476 1.308 0 CA-C-N 121.107 1.776 . . . . 0.0 112.667 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -177.38 29.02 0.07 OUTLIER Glycine 0 C--O 1.23 -0.132 0 O-C-N 120.674 -1.486 . . . . 0.0 113.266 -174.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.6 m -129.58 157.75 41.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.631 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.0 t -44.19 -47.28 9.17 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.067 1.479 . . . . 0.0 112.664 -177.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -131.49 -59.3 0.97 Allowed 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.322 1.449 . . . . 0.0 110.21 177.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.4 p -140.33 153.3 21.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 122.676 1.227 . . . . 0.0 110.919 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.414 ' SG ' HD12 ' A' ' 22' ' ' LEU . 2.4 t -93.78 137.02 33.47 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.101 174.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.539 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.2 OUTLIER -113.17 140.09 48.21 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 122.509 1.147 . . . . 0.0 112.523 176.113 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.589 ' HB2' HD21 ' A' ' 22' ' ' LEU . 11.8 t0 -81.09 101.25 9.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.79 -1.095 . . . . 0.0 111.523 -178.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -62.64 -37.92 88.24 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 117.644 -1.17 . . . . 0.0 112.127 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.4 t -59.47 -37.07 77.26 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.361 1.464 . . . . 0.0 112.414 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.5 mtmp? -84.74 -34.63 22.82 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 175.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.539 HD11 ' SG ' ' A' ' 32' ' ' CYS . 28.3 mt -60.84 -61.12 2.81 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.744 0.817 . . . . 0.0 109.766 177.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.1 p -149.19 164.76 33.84 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 122.98 1.371 . . . . 0.0 112.566 -177.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -78.03 -35.55 34.39 Favored Glycine 0 CA--C 1.526 0.751 0 O-C-N 119.561 -1.962 . . . . 0.0 111.99 175.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.7 t -46.4 -47.97 18.75 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 119.043 1.422 . . . . 0.0 112.877 -171.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -85.27 -37.84 19.56 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 124.667 1.187 . . . . 0.0 112.76 175.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.35 54.84 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.98 1.276 . . . . 0.0 114.216 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -81.78 12.29 4.11 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.766 1.626 . . . . 0.0 114.28 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.5 22.26 76.44 Favored Glycine 0 CA--C 1.54 1.594 0 C-N-CA 124.785 1.183 . . . . 0.0 114.49 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -99.96 -175.81 30.63 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 124.506 1.051 . . . . 0.0 112.626 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -151.13 149.65 29.73 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.227 1.011 . . . . 0.0 111.504 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -59.29 130.59 47.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 120.998 -1.064 . . . . 0.0 112.442 172.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -128.46 151.89 77.41 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.75 0.82 . . . . 0.0 111.435 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.03 153.63 67.47 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.506 2.137 . . . . 0.0 110.616 176.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.98 -20.46 62.44 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -73.93 -18.92 60.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.511 1.524 . . . . 0.0 113.399 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -86.72 129.57 34.82 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 120.512 -1.367 . . . . 0.0 109.834 174.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -79.64 125.37 29.53 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.94 170.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.36 174.15 3.96 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.4 1.08 . . . . 0.0 110.703 175.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.6 mtpp -86.54 124.26 32.64 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.208 1.003 . . . . 0.0 110.451 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -124.33 139.03 54.29 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 125.097 1.498 . . . . 0.0 112.09 177.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.89 148.98 22.83 Favored 'General case' 0 C--O 1.22 -0.485 0 O-C-N 120.801 -1.187 . . . . 0.0 109.645 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -64.15 -40.05 95.32 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.399 -0.813 . . . . 0.0 112.369 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.79 -32.55 59.93 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.013 0.435 . . . . 0.0 112.058 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.61 -36.73 28.59 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 121.612 -0.68 . . . . 0.0 112.72 -177.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.2 m -54.38 -29.42 48.57 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.116 1.367 . . . . 0.0 112.26 175.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.14 86.2 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 117.963 -1.018 . . . . 0.0 112.94 174.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 29.1 t -44.13 -58.04 3.07 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.791 2.037 . . . . 0.0 112.074 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -80.36 -56.2 4.36 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.878 172.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 42.57 -147.54 0.64 Allowed Glycine 0 C--N 1.35 1.326 0 C-N-CA 127.247 2.356 . . . . 0.0 112.353 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt 49.09 46.47 22.61 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 119.837 1.819 . . . . 0.0 114.277 174.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.77 23.0 62.91 Favored Glycine 0 CA--C 1.531 1.069 0 O-C-N 121.266 -0.896 . . . . 0.0 114.201 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -132.24 159.47 38.96 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 126.379 1.872 . . . . 0.0 110.086 177.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -137.98 124.33 20.6 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 126.439 1.895 . . . . 0.0 109.835 -178.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.53 125.94 28.24 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.517 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.1 m -120.08 137.79 53.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 120.055 1.298 . . . . 0.0 111.798 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.1 p -106.79 144.52 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-O 122.12 0.962 . . . . 0.0 110.395 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -111.37 177.72 4.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.82 1.248 . . . . 0.0 111.956 172.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.6 pp -104.87 27.53 8.01 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.598 1.559 . . . . 0.0 113.702 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 115.436 -2.221 . . . . 0.0 113.169 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.11 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -113.58 -38.95 4.18 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.884 0.74 . . . . 0.0 111.939 -171.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.2 m -47.86 -54.95 10.94 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.07 -1.019 . . . . 0.0 111.863 173.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.9 p -57.41 -34.09 45.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 125.065 1.346 . . . . 0.0 112.795 176.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.9 t -64.5 -29.48 70.52 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.33 1.452 . . . . 0.0 111.73 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.411 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 24.5 mmmt -94.37 -3.55 50.12 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 113.994 1.109 . . . . 0.0 113.994 172.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 78.01 35.26 35.31 Favored Glycine 0 CA--C 1.534 1.261 0 CA-C-N 118.797 0.726 . . . . 0.0 113.073 -176.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.483 ' CD1' ' HA ' ' A' ' 33' ' ' ASP . 39.0 m-85 -99.19 166.3 11.3 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.949 1.3 . . . . 0.0 112.466 173.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.82 143.62 17.53 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.255 0.931 . . . . 0.0 111.308 179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.4 m -81.82 131.38 35.26 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.724 -0.868 . . . . 0.0 110.861 174.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -141.51 156.84 66.61 Favored Pre-proline 0 N--CA 1.471 0.589 0 C-N-CA 123.536 0.734 . . . . 0.0 111.144 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.69 139.28 62.61 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 122.731 2.287 . . . . 0.0 110.727 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -53.28 -18.84 2.68 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 115.546 1.684 . . . . 0.0 115.546 175.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -71.31 -47.11 58.7 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.415 1.886 . . . . 0.0 111.902 170.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -78.69 -36.07 44.16 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.573 1.149 . . . . 0.0 111.993 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.7 t -88.17 112.03 46.86 Favored Pre-proline 0 C--O 1.246 0.869 0 C-N-CA 123.878 0.871 . . . . 0.0 111.668 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -61.91 153.96 64.79 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 123.033 2.489 . . . . 0.0 110.937 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -50.47 -35.07 27.34 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.026 -1.046 . . . . 0.0 113.798 175.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -71.1 -20.76 62.3 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.341 1.056 . . . . 0.0 113.378 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.85 -19.21 16.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.372 1.869 . . . . 0.0 114.656 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.424 ' HD3' HG21 ' A' ' 30' ' ' VAL . 71.6 mtt180 -61.17 115.54 3.87 Favored 'General case' 0 CA--C 1.522 -0.104 0 O-C-N 121.25 -0.906 . . . . 0.0 109.982 173.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.638 HD11 ' HB3' ' A' ' 33' ' ' ASP . 11.9 mt -100.64 166.78 10.72 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.721 0.772 . . . . 0.0 110.846 178.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.32 27.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.811 1.244 . . . . 0.0 112.573 177.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.489 ' CE2' HD13 ' A' ' 22' ' ' LEU . 68.1 m-85 -65.46 -22.47 66.75 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.117 -0.989 . . . . 0.0 112.666 175.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.61 76.95 0.2 Allowed Glycine 0 CA--C 1.532 1.096 0 CA-C-N 120.025 1.284 . . . . 0.0 113.696 178.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -175.25 31.63 0.09 OUTLIER Glycine 0 N--CA 1.464 0.501 0 O-C-N 121.141 -1.211 . . . . 0.0 113.324 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.7 m -136.98 148.24 46.79 Favored 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 124.198 0.999 . . . . 0.0 111.272 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.9 m -58.65 -41.92 87.16 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.799 0.84 . . . . 0.0 112.053 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 51.9 p -109.55 -75.19 0.63 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.401 1.08 . . . . 0.0 109.069 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' A' ' 21' ' ' ARG . 13.8 p -147.18 149.11 15.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 126.337 1.855 . . . . 0.0 109.687 177.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 4.9 t -76.98 128.13 33.96 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.636 171.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -114.36 131.45 56.55 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.403 1.081 . . . . 0.0 111.25 177.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.638 ' HB3' HD11 ' A' ' 22' ' ' LEU . 1.5 p30 -84.58 97.7 9.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 124.186 1.946 . . . . 0.0 113.219 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.469 HD22 ' HB3' ' A' ' 41' ' ' LYS . 16.0 mt -54.67 -35.53 63.63 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.161 178.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.1 m -65.16 -29.37 70.2 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.6 mtpp -86.58 -37.93 17.65 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.476 1.034 . . . . 0.0 112.216 174.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.9 mp -64.81 -66.14 0.58 Allowed 'General case' 0 C--N 1.342 0.276 0 C-N-CA 123.913 0.885 . . . . 0.0 110.891 175.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 t -176.02 136.49 0.3 Allowed 'General case' 0 C--O 1.24 0.571 0 CA-C-O 122.09 0.948 . . . . 0.0 112.997 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.03 -27.91 39.28 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-O 118.082 -1.399 . . . . 0.0 113.215 175.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 35.0 t -50.03 -48.46 52.73 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 118.097 0.948 . . . . 0.0 110.162 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.469 ' HB3' HD22 ' A' ' 34' ' ' LEU . 54.1 mttt -82.72 -36.17 26.04 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 176.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.28 -41.88 87.72 Favored Glycine 0 CA--C 1.531 1.032 0 C-N-CA 123.961 0.791 . . . . 0.0 113.765 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -83.92 16.55 2.77 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.644 1.578 . . . . 0.0 114.069 174.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.19 42.19 76.92 Favored Glycine 0 CA--C 1.538 1.525 0 C-N-CA 124.465 1.031 . . . . 0.0 114.499 178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -123.08 175.06 16.56 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.043 1.782 . . . . 0.0 113.925 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -150.66 149.03 29.32 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.993 1.317 . . . . 0.0 111.048 -175.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -65.84 123.0 18.6 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.119 -0.988 . . . . 0.0 111.483 173.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -127.34 148.22 65.36 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 124.636 1.175 . . . . 0.0 111.22 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -68.02 157.07 63.4 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.458 2.105 . . . . 0.0 111.125 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.4 mt -62.07 -21.89 65.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 177.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -75.22 -13.07 60.41 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.255 2.222 . . . . 0.0 113.008 173.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.51 126.76 35.41 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 119.749 -1.845 . . . . 0.0 110.269 174.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -78.29 117.6 19.7 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.798 0.839 . . . . 0.0 110.076 171.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 34.2 t -163.06 176.87 9.64 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.333 1.453 . . . . 0.0 109.553 171.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -91.42 106.85 18.79 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 125.505 1.522 . . . . 0.0 110.147 172.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -101.3 141.94 33.44 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.037 0.922 . . . . 0.0 111.196 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.483 HD23 ' HG2' ' A' ' 60' ' ' GLU . 16.7 tp -89.98 134.84 34.0 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.071 -1.018 . . . . 0.0 109.526 170.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 pm0 -48.85 -44.93 40.08 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.079 1.352 . . . . 0.0 112.381 172.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.35 -23.64 64.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.715 1.206 . . . . 0.0 112.752 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.483 ' HG2' HD23 ' A' ' 57' ' ' LEU . 38.2 mm-40 -90.4 -39.02 12.92 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.947 1.299 . . . . 0.0 112.935 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.1 p -54.21 -28.5 41.29 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.936 -1.103 . . . . 0.0 112.603 173.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.78 -36.42 69.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.462 1.505 . . . . 0.0 113.157 175.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.3 m -70.63 -48.52 54.58 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.603 1.161 . . . . 0.0 113.281 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 17.3 m -62.29 -40.03 94.93 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 102.14 -176.35 25.63 Favored Glycine 0 CA--C 1.531 1.061 0 CA-C-O 122.616 1.12 . . . . 0.0 112.859 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -63.95 143.24 58.01 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.988 -1.301 . . . . 0.0 111.571 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.06 10.62 85.98 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 119.133 -0.815 . . . . 0.0 114.385 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -137.15 160.59 38.55 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.624 1.57 . . . . 0.0 110.694 177.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -137.83 117.32 12.91 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 126.312 1.845 . . . . 0.0 110.543 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.0 t -74.73 97.59 3.27 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.815 -0.553 . . . . 0.0 110.967 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -77.31 161.67 27.9 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.605 1.562 . . . . 0.0 110.821 173.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.7 t -123.67 134.72 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.035 1.334 . . . . 0.0 109.745 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -107.92 -63.52 1.31 Allowed 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.353 1.061 . . . . 0.0 112.065 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.0 mp -72.32 147.04 46.73 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 . . . . . 0 C--O 1.255 1.356 0 CA-C-O 116.196 -1.859 . . . . 0.0 114.411 177.926 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . 0.482 HD22 ' N ' ' A' ' 2' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.482 ' N ' HD22 ' A' ' 1' ' ' ASN . 3.9 mm-40 -116.9 -44.64 2.81 Favored 'General case' 0 C--O 1.22 -0.475 0 O-C-N 123.612 0.57 . . . . 0.0 109.728 -176.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.4 m -47.8 -55.92 8.58 Favored 'General case' 0 CA--C 1.527 0.091 0 O-C-N 121.658 -0.651 . . . . 0.0 111.284 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.5 p -58.91 -31.06 44.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.017 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.1 t -63.72 -30.12 71.26 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.727 0.811 . . . . 0.0 110.544 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.528 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 27.0 mmtt -96.18 -9.23 31.03 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.26 29.17 25.79 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 119.195 -0.78 . . . . 0.0 111.906 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.528 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 61.8 m-85 -89.75 168.74 11.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 118.331 1.065 . . . . 0.0 111.715 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.66 126.66 6.92 Favored Glycine 0 CA--C 1.519 0.306 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.546 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.0 m -75.78 139.43 41.8 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.95 -0.735 . . . . 0.0 111.076 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 80.5 mt -154.99 155.0 29.78 Favored Pre-proline 0 C--O 1.206 -1.202 0 O-C-N 124.19 0.931 . . . . 0.0 112.051 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.532 ' HA ' HG21 ' A' ' 29' ' ' THR . 51.0 Cg_endo -68.06 133.95 30.4 Favored 'Trans proline' 0 CA--C 1.506 -0.916 0 C-N-CA 123.98 3.12 . . . . 0.0 111.116 179.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.406 ' HG3' ' CG1' ' A' ' 30' ' ' VAL . 63.2 mt-30 -47.34 -27.83 1.77 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 123.191 0.596 . . . . 0.0 111.397 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.6 p -59.73 -47.43 85.7 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -83.12 -30.89 27.55 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.338 0.59 . . . . 0.0 112.46 177.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 20' ' ' ALA . 17.7 t -93.19 126.63 50.1 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 121.71 -0.619 . . . . 0.0 111.694 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.512 ' HG2' ' HB2' ' A' ' 20' ' ' ALA . 50.0 Cg_endo -67.49 153.01 77.81 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.855 2.37 . . . . 0.0 112.265 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -52.91 -35.08 57.72 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 pm0 -73.23 -16.34 61.41 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 123.927 0.891 . . . . 0.0 111.13 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.512 ' HB2' ' HG2' ' A' ' 17' ' ' PRO . . . -95.29 -30.26 14.05 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 124.072 0.858 . . . . 0.0 113.052 177.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -54.27 113.01 1.1 Allowed 'General case' 0 C--N 1.334 -0.069 0 O-C-N 121.584 -0.698 . . . . 0.0 110.07 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.551 HD13 ' CE2' ' A' ' 24' ' ' TYR . 13.0 mt -96.33 177.92 5.54 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 121.776 0.798 . . . . 0.0 110.2 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.8 p -122.38 34.58 5.11 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.385 0.674 . . . . 0.0 111.391 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.551 ' CE2' HD13 ' A' ' 22' ' ' LEU . 59.1 m-85 -73.82 -16.87 61.13 Favored 'General case' 0 C--O 1.203 -1.379 0 O-C-N 122.092 -0.38 . . . . 0.0 110.84 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.6 80.99 0.07 OUTLIER Glycine 0 C--O 1.219 -0.839 0 CA-C-O 122.439 1.021 . . . . 0.0 111.905 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.2 26.07 0.04 OUTLIER Glycine 0 C--O 1.223 -0.538 0 O-C-N 120.796 -1.414 . . . . 0.0 112.795 -179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 56.2 m -124.44 156.98 36.27 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 117.02 0.41 . . . . 0.0 111.533 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -48.9 -44.73 40.43 Favored 'General case' 0 C--O 1.223 -0.338 0 O-C-N 123.923 0.765 . . . . 0.0 111.122 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.572 HG23 ' H ' ' A' ' 30' ' ' VAL . 1.2 t -132.34 -60.3 0.9 Allowed 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.601 0.76 . . . . 0.0 110.965 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.572 ' H ' HG23 ' A' ' 29' ' ' THR . 13.9 p -145.35 140.29 22.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 CA-C-O 121.847 0.832 . . . . 0.0 110.988 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.411 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 1.3 t -82.63 140.57 33.1 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.291 -0.88 . . . . 0.0 111.969 176.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -116.19 130.07 56.61 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 122.835 1.302 . . . . 0.0 110.742 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.528 ' O ' HD23 ' A' ' 37' ' ' LEU . 0.8 OUTLIER -76.16 106.39 7.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 123.128 1.442 . . . . 0.0 112.146 177.599 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 mt -64.94 -37.7 88.53 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 119.271 -2.143 . . . . 0.0 110.182 -179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 m -53.18 -32.8 49.72 Favored 'General case' 0 CA--C 1.528 0.123 0 O-C-N 121.803 -0.56 . . . . 0.0 112.05 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.1 mttt -90.65 -32.48 16.2 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.528 HD23 ' O ' ' A' ' 33' ' ' ASP . 3.9 mm? -77.32 -70.46 0.47 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 123.288 0.635 . . . . 0.0 109.745 -178.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.502 HG21 ' HB2' ' A' ' 63' ' ' SER . 9.8 t -140.21 145.9 37.99 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 123.242 1.496 . . . . 0.0 112.145 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -84.56 33.44 3.24 Favored Glycine 0 N--CA 1.451 -0.348 0 O-C-N 119.685 -1.884 . . . . 0.0 112.69 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.3 t -56.84 -39.4 74.19 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 118.138 0.969 . . . . 0.0 110.717 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -80.86 -29.8 35.73 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 121.516 0.674 . . . . 0.0 112.108 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -69.42 -36.19 77.3 Favored Glycine 0 C--N 1.336 0.544 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.0 mttt -78.61 12.67 1.94 Allowed 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.58 42.08 14.63 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.788 -0.525 . . . . 0.0 111.788 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -115.65 169.39 12.91 Favored Glycine 0 CA--C 1.518 0.244 0 CA-C-N 117.033 0.417 . . . . 0.0 112.774 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -149.74 155.91 40.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.833 0.825 . . . . 0.0 112.127 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 t -73.71 130.8 40.73 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.102 -0.999 . . . . 0.0 112.456 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -135.76 148.44 65.35 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 121.598 0.713 . . . . 0.0 112.063 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.18 159.22 54.08 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.506 2.138 . . . . 0.0 111.508 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.464 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 14.4 mt -60.96 -15.84 35.92 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 177.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -84.55 -10.63 57.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.058 0.543 . . . . 0.0 111.455 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.46 129.15 41.34 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 121.775 0.798 . . . . 0.0 109.877 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -80.45 120.51 24.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.715 176.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -172.83 170.53 4.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.456 0.646 . . . . 0.0 111.169 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 tttt -83.08 111.13 18.6 Favored 'General case' 0 CA--C 1.522 -0.121 0 O-C-N 121.859 -0.525 . . . . 0.0 110.456 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -117.87 128.96 55.34 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.746 0.784 . . . . 0.0 111.293 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.607 HD12 ' HG3' ' A' ' 60' ' ' GLU . 15.7 mt -84.82 156.39 21.35 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.589 -0.694 . . . . 0.0 110.636 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -69.61 -33.95 73.39 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.351 178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.47 -31.05 33.17 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-O 120.82 0.343 . . . . 0.0 111.813 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.607 ' HG3' HD12 ' A' ' 57' ' ' LEU . 8.7 mm-40 -80.45 -30.98 37.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.983 0.42 . . . . 0.0 111.007 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.406 ' HB2' ' HD3' ' A' ' 69' ' ' LYS . 93.6 p -55.31 -37.87 67.93 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.628 -0.67 . . . . 0.0 111.588 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.96 -36.69 72.92 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 123.525 0.516 . . . . 0.0 112.074 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.502 ' HB2' HG21 ' A' ' 38' ' ' THR . 47.0 t -54.42 -54.37 41.69 Favored 'General case' 0 C--N 1.334 -0.108 0 O-C-N 123.411 0.444 . . . . 0.0 111.474 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 8.8 m -57.06 -49.97 74.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.377 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 116.21 175.6 17.92 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-O 122.496 1.053 . . . . 0.0 112.067 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -61.4 129.24 40.25 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.329 -1.101 . . . . 0.0 110.436 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.36 6.58 70.79 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 113.483 -179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -141.93 162.5 35.31 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.395 0.617 . . . . 0.0 110.951 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.464 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 64.5 mmtt -138.49 138.75 38.37 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 122.133 0.968 . . . . 0.0 111.93 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -84.49 106.04 15.76 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.583 -0.698 . . . . 0.0 110.672 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -85.33 156.17 21.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.674 0.75 . . . . 0.0 111.795 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.9 p -128.12 144.65 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 C-N-CA 123.226 0.61 . . . . 0.0 111.18 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -118.72 -179.9 3.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.541 0.686 . . . . 0.0 111.853 176.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.464 ' C ' HD12 ' A' ' 74' ' ' LEU . 4.0 pp -124.73 171.45 10.09 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.377 0.671 . . . . 0.0 111.878 178.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.3 t60 . . . . . 0 C--O 1.248 0.987 0 CA-C-O 116.966 -1.492 . . . . 0.0 111.935 176.816 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.479 1.016 0 CA-C-O 118.197 -0.906 . . . . 0.0 109.157 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -116.48 -28.92 6.31 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 123.644 0.59 . . . . 0.0 111.004 -173.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.2 m -53.67 -48.24 69.65 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 120.513 -1.367 . . . . 0.0 111.829 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 p -56.43 -27.1 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.552 1.141 . . . . 0.0 113.187 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 t -66.8 -35.19 79.49 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.875 1.27 . . . . 0.0 111.287 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.455 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 3.6 mmmm -96.9 -7.65 32.79 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 174.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.25 44.35 7.05 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 124.203 0.906 . . . . 0.0 112.396 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.455 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 35.6 m-85 -108.65 163.31 13.36 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.091 1.356 . . . . 0.0 112.169 176.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.77 145.29 18.4 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.276 0.941 . . . . 0.0 111.382 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.5 m -83.13 136.3 34.5 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.7 -0.883 . . . . 0.0 112.025 175.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.1 mt -148.6 155.83 41.8 Favored Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.738 0.815 . . . . 0.0 111.857 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.53 142.69 79.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.431 2.087 . . . . 0.0 110.884 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -52.54 -21.18 3.54 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 175.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 t -74.17 -46.96 38.92 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.102 1.761 . . . . 0.0 112.868 170.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -68.37 -50.27 54.28 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.276 1.03 . . . . 0.0 110.775 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.3 t -84.53 118.21 70.55 Favored Pre-proline 0 C--O 1.246 0.88 0 O-C-N 121.566 -0.709 . . . . 0.0 111.535 -174.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -63.02 151.06 86.67 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.793 2.329 . . . . 0.0 110.847 -177.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -52.33 -24.32 7.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -79.55 -28.73 41.21 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.367 1.467 . . . . 0.0 113.989 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -24.47 22.4 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.562 1.145 . . . . 0.0 111.206 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HG2' HG21 ' A' ' 30' ' ' VAL . 97.0 mtt180 -48.32 117.99 2.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.412 0.685 . . . . 0.0 110.885 174.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.436 HD21 ' HB2' ' A' ' 33' ' ' ASP . 19.5 mt -99.77 172.08 7.48 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.923 0.868 . . . . 0.0 110.455 179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.6 p -100.65 11.29 39.83 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 125.848 1.659 . . . . 0.0 112.985 177.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.418 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 54.4 m-85 -77.44 -11.74 59.88 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.133 -0.98 . . . . 0.0 112.2 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.72 -106.23 0.57 Allowed Glycine 0 C--O 1.216 -1.0 0 CA-C-O 116.771 -2.127 . . . . 0.0 110.176 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 39.48 28.04 0.1 Allowed Glycine 0 N--CA 1.474 1.21 0 C-N-CA 127.342 2.401 . . . . 0.0 115.419 175.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.0 m -145.67 146.71 31.4 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 125.441 1.496 . . . . 0.0 108.972 -169.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 m -68.66 -22.71 64.38 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 p -127.0 -75.86 0.58 Allowed 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 125.943 1.697 . . . . 0.0 110.659 -175.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.454 HG21 ' HG2' ' A' ' 21' ' ' ARG . 7.1 p -148.58 150.44 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 O-C-N 121.312 -0.868 . . . . 0.0 110.863 174.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 8.2 t -78.77 129.44 34.64 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 121.516 -0.74 . . . . 0.0 110.354 172.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.407 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.7 OUTLIER -111.83 140.21 46.67 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 122.245 1.022 . . . . 0.0 112.964 177.527 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.436 ' HB2' HD21 ' A' ' 22' ' ' LEU . 14.4 t0 -88.98 104.31 16.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.262 1.029 . . . . 0.0 110.987 -178.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.508 HD22 ' HB3' ' A' ' 41' ' ' LYS . 53.7 mt -58.37 -33.11 69.21 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.32 -0.848 . . . . 0.0 112.022 175.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 t -68.24 -31.13 70.4 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.122 1.369 . . . . 0.0 111.868 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt -84.99 -38.78 18.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.808 1.243 . . . . 0.0 111.89 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.407 HD11 ' SG ' ' A' ' 32' ' ' CYS . 43.0 mt -61.06 -60.21 4.14 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.089 0.955 . . . . 0.0 111.011 176.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.2 t -171.39 155.64 4.28 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 122.16 0.981 . . . . 0.0 113.564 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.89 -29.06 71.34 Favored Glycine 0 CA--C 1.534 1.275 0 O-C-N 120.28 -1.513 . . . . 0.0 113.786 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.5 t -52.09 -47.37 65.27 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.395 1.597 . . . . 0.0 110.233 -174.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.508 ' HB3' HD22 ' A' ' 34' ' ' LEU . 39.0 mmtt -86.3 -38.27 17.69 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.606 1.162 . . . . 0.0 113.194 175.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -51.99 -42.85 54.94 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 124.157 0.884 . . . . 0.0 113.601 178.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.568 ' HE3' ' OE1' ' A' ' 60' ' ' GLU . 7.6 mtmp? -78.99 15.44 1.11 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.033 1.733 . . . . 0.0 113.928 173.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.11 32.67 83.21 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 126.251 1.881 . . . . 0.0 114.42 -176.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -97.14 170.99 26.52 Favored Glycine 0 CA--C 1.527 0.784 0 CA-C-O 122.779 1.211 . . . . 0.0 113.417 177.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 66.2 tt0 -138.93 150.07 45.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.148 1.379 . . . . 0.0 111.756 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 90.5 m -71.87 120.25 17.2 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 120.754 -1.216 . . . . 0.0 111.192 173.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -110.52 150.69 42.02 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 124.307 1.043 . . . . 0.0 110.661 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.04 152.45 76.63 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.635 2.224 . . . . 0.0 111.543 176.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.663 HD11 ' HA2' ' A' ' 67' ' ' GLY . 39.6 mt -57.59 -24.52 56.77 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -73.76 -19.58 60.74 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.163 1.785 . . . . 0.0 112.862 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -89.18 134.82 33.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 123.08 1.419 . . . . 0.0 110.744 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.2 mp0 -96.54 120.73 37.38 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 125.069 1.348 . . . . 0.0 109.439 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.6 p -166.76 170.67 12.19 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.174 1.39 . . . . 0.0 109.953 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -73.62 108.01 6.21 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.624 1.17 . . . . 0.0 109.863 175.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.91 145.58 42.05 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.075 0.95 . . . . 0.0 109.783 174.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.4 tp -97.02 139.75 32.56 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.176 0.59 . . . . 0.0 110.326 173.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -63.14 -42.08 99.4 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.599 -0.688 . . . . 0.0 112.525 177.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.78 -34.05 76.98 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.592 -0.692 . . . . 0.0 111.991 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.568 ' OE1' ' HE3' ' A' ' 43' ' ' LYS . 3.8 tp10 -85.7 -33.79 21.43 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.395 1.078 . . . . 0.0 113.482 -177.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.7 p -53.11 -34.2 55.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.693 1.597 . . . . 0.0 112.377 173.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.61 -36.18 71.44 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.38 1.072 . . . . 0.0 111.844 176.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 38.9 t -59.95 -48.25 82.47 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 124.327 1.051 . . . . 0.0 112.473 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 67.6 m -60.84 -41.97 96.85 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 122.448 0.299 . . . . 0.0 111.693 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 113.37 174.24 18.89 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 122.679 1.155 . . . . 0.0 112.732 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -64.53 129.12 38.65 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.707 0.803 . . . . 0.0 109.76 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.663 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 88.36 13.99 62.69 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-O 117.871 -1.516 . . . . 0.0 113.42 -177.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -139.57 156.36 46.93 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.663 1.585 . . . . 0.0 110.639 176.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -127.04 119.0 25.55 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.253 1.821 . . . . 0.0 110.118 -179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.2 t -76.04 104.95 6.82 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.415 -0.803 . . . . 0.0 111.408 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 60.9 m -101.23 161.19 13.79 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.712 0.768 . . . . 0.0 112.058 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.8 m -116.22 145.07 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.604 0.762 . . . . 0.0 110.993 176.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -104.88 -80.06 0.55 Allowed 'General case' 0 N--CA 1.461 0.094 0 CA-C-O 118.503 -0.76 . . . . 0.0 110.402 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.6 mp 37.74 52.45 1.41 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.151 1.78 . . . . 0.0 113.055 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 . . . . . 0 C--O 1.248 1.008 0 C-N-CA 125.911 1.684 . . . . 0.0 110.093 -177.071 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 120.598 0.237 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -111.66 -20.75 12.01 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.302 -167.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 97.0 m -51.49 -63.18 1.22 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.275 1.03 . . . . 0.0 111.421 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.6 p -56.59 -34.81 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 112.773 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.5 t -62.64 -26.05 68.43 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.949 1.3 . . . . 0.0 112.422 178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 6' ' ' LYS . 2.6 mmpt? -99.25 -7.18 26.79 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 171.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.38 28.74 35.33 Favored Glycine 0 CA--C 1.535 1.315 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.377 -175.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -90.54 160.84 15.76 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 119.672 1.736 . . . . 0.0 113.649 175.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.42 123.83 7.7 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 125.771 1.653 . . . . 0.0 111.797 -178.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -73.85 131.11 41.16 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 121.333 -1.098 . . . . 0.0 111.283 172.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 70.6 mt -142.19 164.19 35.11 Favored Pre-proline 0 N--CA 1.472 0.649 0 C-N-CA 123.021 0.528 . . . . 0.0 110.583 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.42 141.49 35.19 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.161 1.907 . . . . 0.0 111.656 171.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -51.02 -15.57 0.33 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.864 1.666 . . . . 0.0 115.181 173.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 t -78.27 -39.54 39.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.953 2.101 . . . . 0.0 113.021 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -86.25 -37.1 18.95 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.69 1.596 . . . . 0.0 110.924 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.3 t -92.49 116.33 66.31 Favored Pre-proline 0 C--O 1.245 0.856 0 C-N-CA 124.431 1.092 . . . . 0.0 111.921 -177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.76 151.22 86.49 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.541 2.161 . . . . 0.0 111.672 -175.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -53.8 -28.71 36.75 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -72.89 -19.7 61.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.697 1.199 . . . . 0.0 113.658 176.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -102.65 -16.08 16.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 128.048 2.539 . . . . 0.0 114.276 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.519 ' HG2' HG21 ' A' ' 30' ' ' VAL . 89.5 mtt180 -59.74 105.25 0.36 Allowed 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.254 -0.903 . . . . 0.0 112.2 171.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.617 HD11 ' HB3' ' A' ' 33' ' ' ASP . 10.7 mt -93.6 163.32 13.6 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 111.846 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 p -103.71 22.39 14.5 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.11 1.764 . . . . 0.0 114.407 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.551 ' CE2' HD13 ' A' ' 22' ' ' LEU . 85.2 m-85 -67.79 3.51 1.44 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 125.964 1.706 . . . . 0.0 115.452 175.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 38.98 64.33 0.93 Allowed Glycine 0 N--CA 1.475 1.261 0 C-N-CA 126.917 2.199 . . . . 0.0 114.876 171.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -165.22 28.17 0.2 Allowed Glycine 0 C--O 1.226 -0.395 0 CA-C-O 118.738 -1.035 . . . . 0.0 113.472 -173.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 53.6 m -130.42 161.91 30.31 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.6 0.76 . . . . 0.0 112.422 177.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -53.54 -36.34 61.71 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.508 1.123 . . . . 0.0 113.549 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -147.29 -50.29 0.19 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.543 1.137 . . . . 0.0 111.074 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.519 HG21 ' HG2' ' A' ' 21' ' ' ARG . 11.9 p -147.24 149.29 15.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 122.07 0.938 . . . . 0.0 111.432 174.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.412 ' HB3' ' HB2' ' A' ' 22' ' ' LEU . 4.2 t -89.7 137.66 32.14 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 124.355 1.062 . . . . 0.0 108.8 172.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -115.16 133.18 56.27 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.105 0.962 . . . . 0.0 111.225 177.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.617 ' HB3' HD11 ' A' ' 22' ' ' LEU . 2.7 p30 -82.36 90.01 6.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 123.97 1.843 . . . . 0.0 112.679 -177.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.9 mt -50.31 -33.66 20.91 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.123 1.156 . . . . 0.0 114.123 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.4 t -79.33 -11.51 59.93 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.81 -37.28 8.35 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.213 1.405 . . . . 0.0 109.911 178.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.29 -53.32 37.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.651 1.58 . . . . 0.0 111.753 171.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 82.6 p -141.69 179.33 6.9 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.17 0.988 . . . . 0.0 111.342 -175.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -94.02 -54.34 1.64 Allowed Glycine 0 CA--C 1.526 0.76 0 O-C-N 120.055 -1.653 . . . . 0.0 111.325 172.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.6 t -44.89 -61.82 1.46 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.861 1.664 . . . . 0.0 110.858 -172.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.455 ' HE2' ' OE2' ' A' ' 46' ' ' GLU . 34.1 mmtp -56.35 -46.31 80.02 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.371 1.468 . . . . 0.0 112.935 176.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.91 -29.77 62.4 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.116 0.865 . . . . 0.0 115.011 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -87.51 8.22 25.92 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.14 32.78 30.93 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.341 0.972 . . . . 0.0 113.422 -174.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -91.8 164.03 28.65 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 124.282 0.944 . . . . 0.0 113.332 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.455 ' OE2' ' HE2' ' A' ' 41' ' ' LYS . 8.6 tp10 -152.13 151.8 31.51 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.574 1.15 . . . . 0.0 112.539 178.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 36.4 m -70.19 121.46 17.6 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.874 -1.141 . . . . 0.0 111.369 174.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -121.89 148.25 50.72 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.977 0.911 . . . . 0.0 111.784 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -69.29 155.44 67.48 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.456 2.104 . . . . 0.0 110.697 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.7 mt -60.59 -21.31 62.49 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -74.17 -20.53 60.18 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 128.258 2.623 . . . . 0.0 112.86 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -88.62 119.89 29.5 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.298 -1.501 . . . . 0.0 110.638 177.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -63.04 117.67 6.78 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.136 0.574 . . . . 0.0 111.09 168.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 43.9 t -155.66 -173.1 4.39 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.305 1.042 . . . . 0.0 110.055 166.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 ttmt -96.84 108.1 20.71 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.201 1.8 . . . . 0.0 110.098 167.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -107.87 147.67 30.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 174.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.66 120.36 42.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.402 1.481 . . . . 0.0 110.255 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.406 ' NE2' ' H ' ' A' ' 58' ' ' GLN . 5.7 mp0 -55.36 -34.79 64.58 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.609 0.764 . . . . 0.0 111.685 -176.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.77 -39.4 65.35 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.693 2.397 . . . . 0.0 113.956 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -105.85 -13.73 15.43 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.143 1.377 . . . . 0.0 112.386 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -55.83 -37.57 68.87 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.14 -1.6 . . . . 0.0 112.108 174.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.83 -32.0 71.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.54 1.536 . . . . 0.0 113.417 173.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -63.94 -48.96 74.48 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.268 1.427 . . . . 0.0 111.971 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.9 t -67.98 -29.93 69.08 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 175.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 103.73 176.62 25.89 Favored Glycine 0 CA--C 1.532 1.119 0 CA-C-O 122.865 1.258 . . . . 0.0 113.672 176.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -64.68 130.76 44.79 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.841 -1.388 . . . . 0.0 111.822 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.54 4.79 60.56 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 124.108 0.861 . . . . 0.0 114.054 -178.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -132.82 161.23 34.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.695 1.598 . . . . 0.0 110.594 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -138.17 120.18 15.51 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.046 1.738 . . . . 0.0 110.788 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.2 t -73.25 92.17 1.75 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 122.778 0.431 . . . . 0.0 110.579 177.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.4 t -80.35 160.22 25.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.936 1.694 . . . . 0.0 110.667 177.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.8 p -133.53 143.12 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.134 0.973 . . . . 0.0 111.0 173.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 36.1 m95 -109.69 179.22 4.19 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.32 1.048 . . . . 0.0 110.335 177.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -59.07 148.53 30.71 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.404 -0.81 . . . . 0.0 111.544 166.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.4 ' CD2' ' C ' ' A' ' 75' ' ' HIS . 8.5 p-80 . . . . . 0 C--O 1.248 0.976 0 CA-C-O 115.981 -1.961 . . . . 0.0 112.978 169.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.473 0.713 0 CA-C-O 118.469 -0.777 . . . . 0.0 109.142 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -108.03 -26.49 10.64 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.3 0.571 . . . . 0.0 111.256 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.599 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 73.9 m -51.32 -59.26 4.41 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 120.814 -1.179 . . . . 0.0 111.099 178.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.79 -32.76 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 t -63.11 -31.83 73.07 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.602 1.161 . . . . 0.0 110.994 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -95.09 -11.49 28.17 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-O 117.74 -1.124 . . . . 0.0 113.569 174.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 83.19 33.91 22.04 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 124.157 0.911 . . . . 0.0 112.397 -177.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -80.35 169.17 18.09 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 118.74 1.27 . . . . 0.0 112.342 175.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.851 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -114.84 117.58 4.08 Favored Glycine 0 C--N 1.335 0.522 0 C-N-CA 123.648 0.642 . . . . 0.0 111.544 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.0 m -72.16 131.92 43.45 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.259 175.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 79.8 mt -147.87 156.39 44.32 Favored Pre-proline 0 C--O 1.218 -0.597 0 O-C-N 124.309 1.006 . . . . 0.0 111.224 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.469 ' HA ' HG21 ' A' ' 29' ' ' THR . 56.1 Cg_endo -66.3 139.66 55.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.089 2.526 . . . . 0.0 111.247 175.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -52.22 -20.68 2.78 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 114.182 1.178 . . . . 0.0 114.182 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.1 t -66.74 -48.13 70.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.948 1.299 . . . . 0.0 112.611 170.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -78.44 -38.1 42.06 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.157 0.983 . . . . 0.0 111.361 177.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -87.61 125.86 63.81 Favored Pre-proline 0 CA--C 1.541 0.623 0 O-C-N 120.866 -1.146 . . . . 0.0 111.918 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -63.25 146.36 93.81 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.997 2.465 . . . . 0.0 110.691 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -52.2 -20.38 2.58 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 175.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -81.32 -35.76 30.58 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 125.867 1.667 . . . . 0.0 111.405 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.44 ' HB1' ' OD1' ' A' ' 33' ' ' ASP . . . -83.01 -26.47 31.2 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 176.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -44.84 110.65 0.24 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.243 1.017 . . . . 0.0 111.429 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 33' ' ' ASP . 9.8 mt -95.72 175.15 6.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 122.475 1.131 . . . . 0.0 110.221 -178.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.1 p -127.13 29.23 5.63 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.361 1.064 . . . . 0.0 112.429 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.599 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 9.5 m-85 -71.5 -15.94 62.33 Favored 'General case' 0 C--O 1.213 -0.855 0 O-C-N 121.409 -0.807 . . . . 0.0 111.207 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.14 82.8 0.07 OUTLIER Glycine 0 CA--C 1.53 0.978 0 CA-C-O 124.395 2.108 . . . . 0.0 112.095 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 174.25 32.71 0.03 OUTLIER Glycine 0 C--O 1.227 -0.327 0 O-C-N 120.627 -1.514 . . . . 0.0 113.339 -176.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 19.3 m -131.45 165.98 22.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 122.408 0.283 . . . . 0.0 111.742 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.7 p -54.0 -46.61 71.81 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 124.666 1.229 . . . . 0.0 112.251 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.469 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.4 t -132.15 -54.84 0.98 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.577 1.151 . . . . 0.0 111.424 -178.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 p -149.82 140.77 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 122.296 1.046 . . . . 0.0 110.605 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.667 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 76.6 m -83.2 138.93 33.42 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.904 -1.123 . . . . 0.0 109.98 171.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.755 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -117.1 140.98 48.84 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-O 122.855 1.312 . . . . 0.0 111.056 173.834 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.44 ' OD1' ' HB1' ' A' ' 20' ' ' ALA . 1.2 p30 -76.29 106.84 8.14 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 124.123 1.916 . . . . 0.0 112.889 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.851 HD21 ' HA3' ' A' ' 9' ' ' GLY . 12.5 mt -67.06 -36.19 81.49 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 119.284 -2.135 . . . . 0.0 110.908 -178.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.5 p -67.79 -22.75 65.17 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -35.06 11.01 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 124.054 0.942 . . . . 0.0 110.652 -179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.755 HD11 ' SG ' ' A' ' 32' ' ' CYS . 48.3 mt -66.33 -62.23 1.58 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.928 0.891 . . . . 0.0 111.027 176.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -154.38 141.09 19.02 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.339 0.59 . . . . 0.0 112.379 -178.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.41 -28.78 67.82 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-O 118.432 -1.204 . . . . 0.0 113.265 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 34.8 t -47.02 -57.91 4.54 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 125.026 1.33 . . . . 0.0 109.618 -176.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -83.57 -29.93 27.42 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.297 0.639 . . . . 0.0 112.654 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.08 -38.32 65.92 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 123.604 0.621 . . . . 0.0 113.935 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -89.62 16.1 8.4 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.494 1.518 . . . . 0.0 112.882 176.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.69 34.37 87.22 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.147 0.403 . . . . 0.0 112.732 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.94 174.96 32.24 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-O 122.569 1.094 . . . . 0.0 112.111 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.93 136.27 28.41 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 122.424 1.107 . . . . 0.0 112.136 -177.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.5 t -73.53 123.45 23.96 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 120.899 -1.126 . . . . 0.0 112.488 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -127.28 147.09 60.56 Favored Pre-proline 0 CA--C 1.538 0.501 0 O-C-N 120.639 -1.288 . . . . 0.0 111.088 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -67.25 153.93 75.72 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.33 2.02 . . . . 0.0 110.565 176.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.568 HD11 ' HA2' ' A' ' 67' ' ' GLY . 13.7 mt -61.18 -18.46 58.31 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 176.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.0 -14.99 57.43 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.72 1.208 . . . . 0.0 112.258 176.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -88.93 139.8 30.09 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 120.705 -1.247 . . . . 0.0 110.009 175.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -96.7 122.33 39.52 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.841 0.856 . . . . 0.0 110.808 174.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.4 p -167.67 169.81 11.52 Favored 'General case' 0 C--O 1.214 -0.813 0 C-N-CA 123.224 0.61 . . . . 0.0 110.575 176.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 ttmt -74.06 111.19 8.98 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.937 -0.477 . . . . 0.0 110.575 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.36 136.07 53.8 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 124.97 1.308 . . . . 0.0 111.369 178.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -84.09 143.6 29.59 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 120.885 -1.134 . . . . 0.0 110.734 176.658 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -65.03 -41.87 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.736 0.814 . . . . 0.0 113.089 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.73 -36.15 67.7 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.74 -0.6 . . . . 0.0 111.432 176.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.72 -30.9 51.95 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 121.853 -0.529 . . . . 0.0 111.242 -179.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.416 ' HB2' ' CE ' ' A' ' 69' ' ' LYS . 28.3 p -55.27 -31.34 61.5 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 124.552 1.141 . . . . 0.0 111.722 178.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.93 -34.76 65.92 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 118.058 -0.973 . . . . 0.0 112.813 176.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.4 t -46.53 -53.08 12.03 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.362 1.465 . . . . 0.0 111.886 177.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 2.2 m -87.21 -56.54 3.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.401 174.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 39.48 -147.03 0.19 Allowed Glycine 0 C--O 1.217 -0.947 0 C-N-CA 125.599 1.571 . . . . 0.0 112.094 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 77.8 mttt 47.42 46.37 17.25 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 119.052 1.426 . . . . 0.0 113.909 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.568 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 81.63 19.8 65.21 Favored Glycine 0 CA--C 1.534 1.245 0 N-CA-C 114.241 0.456 . . . . 0.0 114.241 -174.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -139.23 150.98 46.16 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 125.941 1.696 . . . . 0.0 110.23 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -121.2 157.89 29.25 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.402 1.081 . . . . 0.0 109.954 178.046 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 50.6 t -101.5 96.28 7.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.652 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 33.8 m -89.67 144.22 26.17 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.16 0.584 . . . . 0.0 111.455 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.7 p -114.44 142.47 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.099 0.96 . . . . 0.0 110.186 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -108.18 -62.71 1.41 Allowed 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 123.627 0.771 . . . . 0.0 112.601 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -110.67 161.12 16.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.469 1.108 . . . . 0.0 110.513 179.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 115.384 -2.246 . . . . 0.0 113.334 170.954 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 118.606 -0.711 . . . . 0.0 109.898 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -119.97 -27.06 5.44 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.736 0.647 . . . . 0.0 111.096 -175.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -48.8 -59.28 3.69 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.517 -0.739 . . . . 0.0 111.168 176.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.56 -29.01 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.8 t -70.29 -30.03 66.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.442 1.097 . . . . 0.0 111.714 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.2 mmtt -94.4 -10.12 33.52 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 175.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.58 30.69 10.28 Favored Glycine 0 CA--C 1.529 0.907 0 CA-C-O 118.486 -1.175 . . . . 0.0 113.172 -177.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -91.29 169.58 10.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.814 1.307 . . . . 0.0 112.062 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -122.33 133.92 9.49 Favored Glycine 0 CA--C 1.524 0.62 0 C-N-CA 124.102 0.858 . . . . 0.0 111.507 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 68.1 m -81.23 134.85 35.68 Favored 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 121.911 -0.758 . . . . 0.0 111.487 174.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.44 ' O ' HG12 ' A' ' 30' ' ' VAL . 38.6 mt -145.76 155.78 52.24 Favored Pre-proline 0 C--O 1.22 -0.463 0 O-C-N 124.066 0.854 . . . . 0.0 111.87 178.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.08 141.8 71.55 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 123.222 2.615 . . . . 0.0 110.852 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.424 ' HA ' HG11 ' A' ' 30' ' ' VAL . 87.4 mt-30 -54.11 -22.18 10.38 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.7 p -69.23 -46.17 68.01 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 125.409 1.483 . . . . 0.0 113.004 170.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.54 -37.42 56.7 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.991 0.916 . . . . 0.0 111.96 176.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.6 t -89.33 118.75 69.4 Favored Pre-proline 0 C--O 1.243 0.724 0 O-C-N 121.433 -0.792 . . . . 0.0 111.832 -178.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -63.23 150.58 88.2 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 122.711 2.274 . . . . 0.0 110.833 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -54.27 -20.49 7.18 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -82.81 -24.52 33.31 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.884 1.273 . . . . 0.0 113.815 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -97.26 -19.91 18.25 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 125.848 1.659 . . . . 0.0 112.059 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 77.4 mtt180 -53.78 118.85 4.28 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 121.063 -1.023 . . . . 0.0 110.558 175.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.479 HD12 ' HB3' ' A' ' 31' ' ' CYS . 5.3 mt -103.0 173.85 6.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 122.315 1.055 . . . . 0.0 110.519 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.1 p -127.15 28.5 5.74 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.796 1.238 . . . . 0.0 112.176 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -69.63 -18.15 63.57 Favored 'General case' 0 C--O 1.207 -1.156 0 O-C-N 121.481 -0.762 . . . . 0.0 110.988 179.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.88 87.32 0.08 OUTLIER Glycine 0 CA--C 1.526 0.726 0 CA-C-O 124.174 1.986 . . . . 0.0 112.032 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.68 31.15 0.03 OUTLIER Glycine 0 C--O 1.221 -0.718 0 O-C-N 120.346 -1.679 . . . . 0.0 113.694 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.406 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 93.3 m -138.83 145.39 40.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.219 0.509 . . . . 0.0 110.488 176.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.3 t -60.81 -40.78 93.97 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 124.156 0.91 . . . . 0.0 111.447 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.7 p -108.65 -73.62 0.68 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.727 1.211 . . . . 0.0 111.066 -177.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 11' ' ' LEU . 7.9 p -150.76 148.36 15.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 124.864 1.266 . . . . 0.0 110.74 175.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.479 ' HB3' HD12 ' A' ' 22' ' ' LEU . 2.0 m -76.72 136.56 39.07 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 120.948 -1.095 . . . . 0.0 109.964 171.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.438 ' SG ' HD21 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -120.45 133.2 55.45 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 125.067 1.347 . . . . 0.0 112.114 175.665 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.569 ' OD2' ' HE2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -77.29 100.19 5.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 122.915 1.341 . . . . 0.0 113.46 178.547 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.8 mt -59.35 -35.3 73.6 Favored 'General case' 0 C--O 1.22 -0.477 0 O-C-N 120.606 -1.309 . . . . 0.0 111.439 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.2 t -56.63 -39.7 74.12 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.933 0.893 . . . . 0.0 112.622 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.569 ' HE2' ' OD2' ' A' ' 33' ' ' ASP . 27.2 mtmt -83.42 -35.33 25.11 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 123.288 0.635 . . . . 0.0 112.634 176.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.438 HD21 ' SG ' ' A' ' 32' ' ' CYS . 8.9 mp -63.7 -59.58 4.4 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.283 1.033 . . . . 0.0 110.22 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -167.84 143.65 3.93 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 122.469 1.128 . . . . 0.0 113.171 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -72.37 -12.54 76.84 Favored Glycine 0 CA--C 1.525 0.715 0 CA-C-O 117.218 -1.879 . . . . 0.0 113.629 175.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.405 ' HB2' ' CB ' ' A' ' 63' ' ' SER . 17.0 t -44.71 -48.55 10.71 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 120.715 2.257 . . . . 0.0 113.428 -175.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -83.42 -42.38 17.03 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.5 172.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -52.28 -30.11 31.58 Favored Glycine 0 CA--C 1.533 1.211 0 CA-C-N 118.809 0.731 . . . . 0.0 114.227 178.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -78.46 10.75 2.88 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 126.051 1.74 . . . . 0.0 113.45 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 58.31 35.12 77.09 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.503 1.049 . . . . 0.0 112.624 -175.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -104.64 -176.61 24.92 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-O 122.554 1.085 . . . . 0.0 113.309 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -146.62 150.19 34.98 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 123.167 1.46 . . . . 0.0 111.979 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 85.0 m -73.17 118.25 15.9 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.692 -1.255 . . . . 0.0 111.581 174.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -116.26 146.86 38.23 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.908 0.883 . . . . 0.0 111.011 178.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.81 153.19 76.32 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.693 2.262 . . . . 0.0 110.665 176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 21.9 mt -59.75 -25.07 64.56 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 176.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -72.43 -21.16 61.29 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.608 1.163 . . . . 0.0 112.796 175.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -92.58 130.66 38.16 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.006 -1.059 . . . . 0.0 110.705 176.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.26 133.04 44.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.946 174.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.493 ' SG ' ' CH2' ' A' ' 73' ' ' TRP . 0.6 OUTLIER -168.7 178.45 4.66 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.025 0.53 . . . . 0.0 110.288 174.453 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.3 tttt -102.75 105.86 16.37 Favored 'General case' 0 CA--C 1.52 -0.188 0 C-N-CA 123.755 0.822 . . . . 0.0 110.618 175.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -122.14 137.81 54.69 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 124.285 1.034 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -80.56 136.5 36.27 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.535 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -48.67 -37.62 19.0 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.443 ' HB3' HD12 ' A' ' 57' ' ' LEU . . . -78.39 -29.29 47.2 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.788 0.835 . . . . 0.0 112.248 178.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -81.61 -30.23 32.96 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.503 0.721 . . . . 0.0 111.221 177.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.6 t -57.2 -29.61 63.85 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 125.427 1.491 . . . . 0.0 111.385 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.7 -33.72 66.73 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.334 1.054 . . . . 0.0 113.387 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.405 ' CB ' ' HB2' ' A' ' 40' ' ' CYS . 32.8 t -52.29 -61.03 2.53 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.149 0.979 . . . . 0.0 111.833 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.1 m -75.85 -52.43 10.38 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 37.8 -146.31 0.12 Allowed Glycine 0 C--N 1.344 1.016 0 C-N-CA 126.73 2.109 . . . . 0.0 111.455 -176.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mttp 45.81 43.91 10.35 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 119.944 1.872 . . . . 0.0 114.029 176.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.73 17.71 74.64 Favored Glycine 0 CA--C 1.539 1.566 0 O-C-N 121.544 -0.722 . . . . 0.0 114.899 -175.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -130.31 150.64 51.45 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.878 2.071 . . . . 0.0 109.612 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -115.78 158.81 22.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 125.584 1.554 . . . . 0.0 110.365 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 39.9 t -108.08 92.66 4.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.001 0.52 . . . . 0.0 111.041 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 48.7 t -81.96 163.84 21.89 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.774 0.321 . . . . 0.0 111.661 177.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.3 p -123.14 144.29 33.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.012 1.325 . . . . 0.0 111.693 173.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.493 ' CH2' ' SG ' ' A' ' 54' ' ' CYS . 46.1 m95 -111.86 -177.81 3.27 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.507 1.123 . . . . 0.0 111.859 173.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.4 pp -124.12 30.16 6.19 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.671 1.588 . . . . 0.0 112.947 179.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 7.0 t60 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 116.176 -1.869 . . . . 0.0 111.766 -178.138 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -99.52 -29.94 12.44 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.53 -0.731 . . . . 0.0 110.89 -170.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 66.8 m -53.69 -54.49 37.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.712 1.205 . . . . 0.0 110.757 175.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -55.83 -38.07 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 125.052 1.341 . . . . 0.0 113.456 175.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.9 m -66.65 -23.66 66.18 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.303 1.041 . . . . 0.0 112.462 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 2.5 mmmm -97.03 -3.87 40.69 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 170.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.53 43.1 20.35 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 123.724 0.678 . . . . 0.0 112.319 -176.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 40.4 m-85 -105.63 159.21 16.14 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.54 1.17 . . . . 0.0 112.836 173.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.443 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -108.84 131.05 10.35 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 124.405 1.002 . . . . 0.0 111.796 -178.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.97 130.98 44.32 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.462 0.705 . . . . 0.0 111.86 172.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.1 mt -139.6 162.21 52.46 Favored Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 123.376 0.422 . . . . 0.0 110.782 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.498 ' HA ' HG21 ' A' ' 29' ' ' THR . 57.7 Cg_endo -68.07 138.95 45.25 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.48 2.12 . . . . 0.0 111.509 172.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -53.38 -14.91 0.85 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.813 1.783 . . . . 0.0 115.813 174.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.27 -48.68 19.32 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.735 2.014 . . . . 0.0 112.218 170.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -76.04 -33.64 59.63 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.576 1.151 . . . . 0.0 112.071 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 29.8 t -86.67 115.32 61.91 Favored Pre-proline 0 CA--C 1.545 0.754 0 O-C-N 120.917 -1.115 . . . . 0.0 111.406 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -62.68 152.35 78.64 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.17 1.914 . . . . 0.0 110.914 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -57.64 -19.39 26.17 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.901 0.88 . . . . 0.0 113.093 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -81.5 -25.82 35.67 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.498 1.919 . . . . 0.0 114.531 174.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -101.38 -15.17 17.3 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.912 1.685 . . . . 0.0 112.707 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -53.72 106.29 0.18 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.958 1.303 . . . . 0.0 111.874 172.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.562 HD21 ' CG ' ' A' ' 33' ' ' ASP . 16.0 mt -89.71 165.54 14.14 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 122.252 1.025 . . . . 0.0 111.738 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 t -116.78 21.4 13.39 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.404 1.482 . . . . 0.0 111.936 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.523 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 43.1 m-85 -63.27 -18.59 63.74 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 174.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.24 66.46 2.65 Favored Glycine 0 N--CA 1.474 1.224 0 CA-C-N 120.567 1.531 . . . . 0.0 113.713 176.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.02 31.87 0.29 Allowed Glycine 0 N--CA 1.462 0.428 0 O-C-N 120.905 -1.35 . . . . 0.0 114.038 -175.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 49.0 m -137.83 164.54 28.67 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 124.057 0.943 . . . . 0.0 112.955 175.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 t -61.22 -31.28 71.06 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.498 HG21 ' HA ' ' A' ' 12' ' ' PRO . 3.1 t -139.98 -58.17 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 125.066 1.346 . . . . 0.0 111.716 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.426 ' H ' HG23 ' A' ' 29' ' ' THR . 5.5 p -147.3 155.23 11.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 122.088 0.947 . . . . 0.0 110.755 174.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 74.0 m -95.53 141.42 29.08 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 172.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.429 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -122.03 137.24 54.88 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.248 1.019 . . . . 0.0 111.787 177.51 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.562 ' CG ' HD21 ' A' ' 22' ' ' LEU . 5.1 m-20 -74.23 103.86 4.8 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 122.082 0.944 . . . . 0.0 110.96 -178.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.563 HD22 ' HB3' ' A' ' 41' ' ' LYS . 44.5 mt -57.42 -43.34 83.74 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.967 -1.083 . . . . 0.0 111.749 178.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t -64.82 -33.35 75.8 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.467 1.107 . . . . 0.0 113.743 177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -79.53 -37.4 36.64 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.882 0.873 . . . . 0.0 112.773 176.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.429 HD11 ' SG ' ' A' ' 32' ' ' CYS . 55.2 mt -64.68 -60.03 3.58 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 124.198 0.936 . . . . 0.0 110.814 177.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.7 t -173.83 145.63 1.16 Allowed 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.373 0.669 . . . . 0.0 112.682 -177.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -52.93 -31.19 38.99 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 118.339 -1.256 . . . . 0.0 114.381 176.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.4 t -49.49 -51.76 33.9 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.568 1.684 . . . . 0.0 112.693 175.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.563 ' HB3' HD22 ' A' ' 34' ' ' LEU . 47.7 mttp -84.27 -36.75 22.43 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 122.982 0.513 . . . . 0.0 112.143 177.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.4 -36.8 64.1 Favored Glycine 0 CA--C 1.533 1.163 0 C-N-CA 124.083 0.849 . . . . 0.0 114.201 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -78.33 11.27 2.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.91 1.684 . . . . 0.0 113.448 172.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.39 18.59 63.4 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.239 1.876 . . . . 0.0 114.34 -173.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.76 170.4 54.96 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 124.328 0.966 . . . . 0.0 112.742 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -137.96 142.61 40.5 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 122.733 1.254 . . . . 0.0 111.302 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.1 t -68.21 127.17 31.93 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.461 -0.774 . . . . 0.0 111.54 178.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -124.47 150.47 64.68 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 123.332 0.653 . . . . 0.0 111.887 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -71.12 157.44 57.55 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.384 2.056 . . . . 0.0 111.924 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 38.4 mt -59.83 -27.35 66.56 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 177.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.45 -17.82 62.35 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.216 2.606 . . . . 0.0 113.08 176.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -88.14 129.17 35.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.944 174.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.88 121.36 21.74 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.272 0.629 . . . . 0.0 110.834 167.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.2 t -160.58 -176.93 5.86 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.989 1.316 . . . . 0.0 109.695 167.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.8 tppt? -92.71 126.08 37.63 Favored 'General case' 0 C--O 1.227 -0.124 0 C-N-CA 124.904 1.282 . . . . 0.0 109.312 166.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.483 ' CD ' ' HE3' ' A' ' 69' ' ' LYS . 2.1 pm0 -124.9 146.98 49.07 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 125.325 1.45 . . . . 0.0 110.335 173.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -94.93 148.89 21.83 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.594 -0.691 . . . . 0.0 110.69 175.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -58.97 -42.56 90.2 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.0 0.92 . . . . 0.0 112.699 178.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.52 -30.09 57.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.3 1.04 . . . . 0.0 111.908 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.22 -37.44 20.09 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.053 0.941 . . . . 0.0 111.852 -178.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -58.07 -33.37 68.99 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 120.155 -1.591 . . . . 0.0 112.212 172.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.38 -41.69 72.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.54 0.736 . . . . 0.0 112.346 172.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.8 p -80.79 -19.65 44.3 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 178.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -63.82 -25.24 68.08 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.052 0.842 . . . . 0.0 111.619 174.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.11 163.12 16.72 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 122.419 1.011 . . . . 0.0 112.083 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.2 mttm -61.3 123.44 17.75 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 121.444 -1.033 . . . . 0.0 110.416 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.05 22.89 60.25 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.664 -1.076 . . . . 0.0 113.518 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -135.59 165.65 25.06 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.267 1.827 . . . . 0.0 111.452 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.483 ' HE3' ' CD ' ' A' ' 56' ' ' GLU . 54.6 mtpt -138.76 115.47 10.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.426 1.89 . . . . 0.0 111.941 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 53.3 t -73.39 104.94 4.56 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.91 -0.494 . . . . 0.0 110.921 -176.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.96 158.61 16.63 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.102 0.961 . . . . 0.0 110.994 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.7 m -132.48 145.41 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 C-N-CA 125.712 1.605 . . . . 0.0 110.956 177.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -117.34 -71.81 0.72 Allowed 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.736 1.214 . . . . 0.0 112.827 -176.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.6 166.57 6.66 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.494 1.518 . . . . 0.0 112.094 169.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.2 p80 . . . . . 0 C--O 1.245 0.849 0 C-N-CA 127.164 2.186 . . . . 0.0 116.639 -179.917 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . 0.613 HD22 HG12 ' A' ' 4' ' ' VAL . 2.9 p-10 . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -123.59 -19.48 5.82 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.982 0.913 . . . . 0.0 112.625 -176.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.1 m -54.42 -63.92 1.0 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.016 -1.052 . . . . 0.0 111.056 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.613 HG12 HD22 ' A' ' 1' ' ' ASN . 5.1 p -56.3 -35.2 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.447 0.699 . . . . 0.0 112.703 177.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.4 m -60.65 -29.48 69.29 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.64 1.176 . . . . 0.0 112.002 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.8 mmmm -97.15 -8.94 28.91 Favored 'General case' 0 C--O 1.226 -0.165 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 172.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 81.7 32.4 30.32 Favored Glycine 0 CA--C 1.532 1.132 0 CA-C-O 118.836 -0.98 . . . . 0.0 113.2 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -78.62 170.16 17.1 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.336 1.568 . . . . 0.0 112.549 174.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.753 ' HA3' HD21 ' A' ' 34' ' ' LEU . . . -112.82 116.12 3.91 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 125.321 1.439 . . . . 0.0 111.081 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.43 129.9 38.07 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.694 -0.886 . . . . 0.0 111.699 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.1 mt -143.13 159.08 57.14 Favored Pre-proline 0 C--O 1.22 -0.457 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.888 178.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.412 ' HA ' ' CG2' ' A' ' 29' ' ' THR . 59.3 Cg_endo -68.55 144.97 62.73 Favored 'Trans proline' 0 C--O 1.217 -0.563 0 C-N-CA 123.407 2.738 . . . . 0.0 112.549 173.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.453 ' OE1' HG21 ' A' ' 30' ' ' VAL . 20.5 mm-40 -53.04 -18.97 2.36 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 177.135 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.0 t -72.55 -49.19 34.25 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.694 2.397 . . . . 0.0 111.77 169.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -76.79 -34.2 57.97 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.369 1.067 . . . . 0.0 110.59 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.0 t -95.21 115.34 65.33 Favored Pre-proline 0 C--O 1.242 0.686 0 O-C-N 120.608 -1.308 . . . . 0.0 111.633 -175.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -62.83 153.61 71.62 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.958 2.438 . . . . 0.0 110.746 -177.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -53.44 -31.93 47.53 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.46 -18.13 61.16 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.834 1.254 . . . . 0.0 113.239 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -99.39 -23.45 15.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.32 1.448 . . . . 0.0 113.599 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -53.07 117.71 3.2 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.305 -0.872 . . . . 0.0 110.759 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.479 HD12 ' SG ' ' A' ' 31' ' ' CYS . 2.5 mt -103.35 172.2 6.95 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.375 1.084 . . . . 0.0 111.195 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.3 m -117.83 25.51 10.32 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.122 1.369 . . . . 0.0 112.336 178.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -70.66 -14.66 62.55 Favored 'General case' 0 C--O 1.211 -0.956 0 C-N-CA 123.528 0.731 . . . . 0.0 111.964 177.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.429 ' O ' ' HA ' ' A' ' 1' ' ' ASN . . . 53.33 85.19 0.02 OUTLIER Glycine 0 N--CA 1.469 0.858 0 CA-C-O 123.243 1.468 . . . . 0.0 113.627 175.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 172.16 29.51 0.02 OUTLIER Glycine 0 C--O 1.225 -0.458 0 O-C-N 120.604 -1.527 . . . . 0.0 114.202 -176.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 52.7 m -129.7 158.71 38.62 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.475 1.11 . . . . 0.0 111.169 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.6 m -47.68 -48.57 29.09 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.399 1.08 . . . . 0.0 112.785 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.412 ' CG2' ' HA ' ' A' ' 12' ' ' PRO . 0.1 OUTLIER -128.22 -59.03 1.19 Allowed 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 125.518 1.527 . . . . 0.0 110.961 179.62 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.453 HG21 ' OE1' ' A' ' 13' ' ' GLN . 7.6 p -145.06 145.14 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 122.886 1.327 . . . . 0.0 109.676 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.479 ' SG ' HD12 ' A' ' 22' ' ' LEU . 1.8 t -82.59 139.16 33.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.561 171.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.61 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -117.73 132.88 56.41 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.955 1.702 . . . . 0.0 110.781 174.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.455 ' HB3' HD21 ' A' ' 22' ' ' LEU . 0.7 OUTLIER -74.16 103.49 4.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 123.28 1.514 . . . . 0.0 112.319 176.27 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.753 HD21 ' HA3' ' A' ' 9' ' ' GLY . 16.6 mt -55.06 -42.25 72.49 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.697 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 t -59.24 -38.76 80.82 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.529 1.532 . . . . 0.0 113.205 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -77.06 -37.09 55.35 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.231 -0.89 . . . . 0.0 112.077 175.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.61 HD11 ' SG ' ' A' ' 32' ' ' CYS . 79.0 mt -63.67 -68.01 0.38 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.561 0.745 . . . . 0.0 110.021 176.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 30.8 p -151.17 168.78 23.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 122.858 1.313 . . . . 0.0 112.377 -175.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -83.23 -35.32 18.14 Favored Glycine 0 CA--C 1.525 0.707 0 O-C-N 119.373 -2.08 . . . . 0.0 112.819 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 46.3 t -51.08 -53.95 29.36 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 119.234 1.517 . . . . 0.0 111.006 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.499 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -72.8 -41.93 64.43 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.97 -36.66 74.71 Favored Glycine 0 CA--C 1.533 1.189 0 O-C-N 123.711 0.632 . . . . 0.0 113.247 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.3 mtmm -86.36 16.43 4.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.465 1.906 . . . . 0.0 114.137 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 56.12 47.69 79.23 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.46 1.028 . . . . 0.0 112.993 -179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -101.34 164.36 18.0 Favored Glycine 0 C--O 1.244 0.728 0 C-N-CA 124.799 1.19 . . . . 0.0 113.953 177.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -133.3 145.97 50.93 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.905 1.682 . . . . 0.0 110.625 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.9 m -73.28 121.04 19.73 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.088 -1.008 . . . . 0.0 111.113 175.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -120.23 150.01 50.63 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 123.998 0.919 . . . . 0.0 111.187 177.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -68.95 154.11 71.42 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.434 2.089 . . . . 0.0 110.553 176.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.498 HD23 ' HD3' ' A' ' 69' ' ' LYS . 82.7 mt -60.29 -20.83 60.74 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 114.103 1.149 . . . . 0.0 114.103 174.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -70.54 -17.27 62.93 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.372 1.869 . . . . 0.0 111.952 173.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -92.94 132.35 37.13 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 120.667 -1.27 . . . . 0.0 110.44 177.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -90.05 119.29 30.28 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.627 0.771 . . . . 0.0 110.376 174.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -167.26 166.58 14.69 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 124.769 1.227 . . . . 0.0 110.241 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.3 tttt -71.48 112.11 7.34 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.477 1.111 . . . . 0.0 108.928 175.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.462 ' HG2' ' CE ' ' A' ' 69' ' ' LYS . 1.9 pp20? -120.15 142.85 48.58 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 124.003 0.921 . . . . 0.0 109.618 175.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -98.27 141.18 31.49 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 123.603 0.761 . . . . 0.0 111.191 176.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -62.21 -39.61 93.34 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.073 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.49 -32.34 58.27 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.707 0.765 . . . . 0.0 111.772 178.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.06 -35.56 56.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.9 t -52.18 -34.82 46.89 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.998 1.319 . . . . 0.0 112.359 174.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.97 63.64 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.242 1.017 . . . . 0.0 112.734 176.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 40.4 t -60.08 -54.98 39.51 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.037 1.735 . . . . 0.0 111.176 175.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 87.5 m -63.19 -43.17 98.97 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 117.88 176.85 17.2 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 122.716 1.175 . . . . 0.0 113.098 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -62.42 131.75 50.26 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.793 -0.828 . . . . 0.0 111.597 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.82 -2.87 82.68 Favored Glycine 0 CA--C 1.531 1.064 0 CA-C-O 118.345 -1.253 . . . . 0.0 113.942 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -120.2 164.12 16.72 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.396 1.878 . . . . 0.0 109.656 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.498 ' HD3' HD23 ' A' ' 50' ' ' LEU . 23.7 mtpt -133.55 125.09 28.1 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.239 1.816 . . . . 0.0 109.725 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 t -78.61 100.4 6.97 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 122.855 0.462 . . . . 0.0 111.035 176.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 84.1 m -98.47 136.66 38.27 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.648 0.737 . . . . 0.0 111.043 176.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.6 m -103.66 144.46 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.154 0.982 . . . . 0.0 111.21 177.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.8 m95 -104.91 -78.19 0.57 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.374 0.67 . . . . 0.0 111.326 179.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.9 mp -103.16 103.3 13.34 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.355 1.862 . . . . 0.0 107.662 178.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 60.0 t60 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 116.634 -1.65 . . . . 0.0 115.022 174.664 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.505 -0.773 0 CA-C-O 117.398 -1.287 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -118.43 -29.5 5.46 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 124.8 1.312 . . . . 0.0 109.877 -177.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 68.3 m -56.91 -57.55 12.02 Favored 'General case' 0 C--N 1.34 0.16 0 O-C-N 121.175 -0.953 . . . . 0.0 110.638 178.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -58.26 -33.01 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 121.66 -0.65 . . . . 0.0 112.384 177.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.7 m -62.29 -31.13 71.68 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.329 0.652 . . . . 0.0 111.28 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.41 ' HB2' ' CD2' ' A' ' 8' ' ' PHE . 28.3 mmtm -96.95 -10.44 26.32 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.24 45.5 4.08 Favored Glycine 0 C--O 1.222 -0.651 0 CA-C-O 118.423 -1.209 . . . . 0.0 111.324 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.506 ' CE2' ' CZ ' ' A' ' 24' ' ' TYR . 77.3 m-85 -108.27 163.25 13.35 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.121 0.96 . . . . 0.0 111.358 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 131.84 10.42 Favored Glycine 0 CA--C 1.523 0.536 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.781 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 82.8 m -80.43 118.99 22.54 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 119.169 -0.443 . . . . 0.0 111.048 177.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 30' ' ' VAL . 30.6 mt -132.93 154.95 81.6 Favored Pre-proline 0 C--O 1.211 -0.944 0 O-C-N 124.171 0.92 . . . . 0.0 112.025 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -64.52 141.21 72.67 Favored 'Trans proline' 0 C--O 1.213 -0.769 0 C-N-CA 124.394 3.396 . . . . 0.0 110.395 178.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.594 ' HA ' HG11 ' A' ' 30' ' ' VAL . 1.1 pt20 -49.79 -30.97 10.63 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.896 0.879 . . . . 0.0 112.594 177.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 t -65.85 -44.53 85.18 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 114.185 1.179 . . . . 0.0 114.185 172.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.408 ' OD1' HD13 ' A' ' 11' ' ' LEU . 8.2 t70 -70.5 -47.57 59.86 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.392 0.677 . . . . 0.0 112.363 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -86.0 128.74 56.84 Favored Pre-proline 0 CA--C 1.541 0.615 0 CA-C-O 121.422 0.629 . . . . 0.0 111.9 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -65.5 144.71 80.32 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.289 1.992 . . . . 0.0 110.958 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -51.85 -19.74 1.88 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 173.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -78.31 -36.11 46.92 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.779 0.832 . . . . 0.0 112.792 176.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.72 -28.31 26.4 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 116.026 -1.94 . . . . 0.0 110.776 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.535 ' HG2' HG21 ' A' ' 30' ' ' VAL . 84.0 mtt180 -44.14 119.82 1.92 Allowed 'General case' 0 C--N 1.345 0.396 0 O-C-N 125.105 1.503 . . . . 0.0 110.625 178.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.486 HD13 ' CE2' ' A' ' 24' ' ' TYR . 3.4 mt -103.18 178.4 4.57 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -178.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.2 p -121.35 30.26 6.86 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.157 0.983 . . . . 0.0 111.109 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.506 ' CZ ' ' CE2' ' A' ' 8' ' ' PHE . 62.7 m-85 -69.14 -19.18 64.02 Favored 'General case' 0 C--O 1.202 -1.409 0 CA-C-O 119.085 -0.483 . . . . 0.0 110.461 177.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.53 49.68 75.91 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-N 120.768 1.622 . . . . 0.0 111.804 178.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -143.23 36.67 1.56 Allowed Glycine 0 C--O 1.223 -0.592 0 CA-C-O 117.944 -1.476 . . . . 0.0 112.703 -179.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 91.5 m -144.94 151.25 38.35 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 117.59 0.695 . . . . 0.0 111.4 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 p -63.22 -43.22 98.72 Favored 'General case' 0 C--O 1.224 -0.271 0 O-C-N 123.652 0.595 . . . . 0.0 111.558 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.1 p -105.93 -74.67 0.65 Allowed 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.001 0.52 . . . . 0.0 109.744 -178.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.594 HG11 ' HA ' ' A' ' 13' ' ' GLN . 9.9 p -151.92 144.42 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 123.499 1.619 . . . . 0.0 111.336 -179.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.8 t -80.34 128.24 33.33 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 120.594 -1.316 . . . . 0.0 111.059 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -106.43 138.27 42.92 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 124.049 0.843 . . . . 0.0 112.033 177.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.405 ' CB ' ' HE2' ' A' ' 36' ' ' LYS . 18.6 t0 -83.11 104.66 13.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 10.6 mt -65.26 -30.39 71.26 Favored 'General case' 0 CA--C 1.536 0.41 0 O-C-N 120.837 -1.164 . . . . 0.0 110.854 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 p -59.24 -36.67 75.88 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 120.484 -1.385 . . . . 0.0 112.634 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.405 ' HE2' ' CB ' ' A' ' 33' ' ' ASP . 31.4 mtmt -87.87 -35.53 17.7 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 123.54 0.525 . . . . 0.0 111.853 178.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.479 HD13 ' HA ' ' A' ' 37' ' ' LEU . 2.6 mm? -76.05 -71.98 0.35 Allowed 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.233 0.613 . . . . 0.0 109.865 -178.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 4.9 t -171.63 163.49 6.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 122.604 1.192 . . . . 0.0 111.462 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -94.53 32.28 6.13 Favored Glycine 0 C--O 1.212 -1.269 0 CA-C-O 116.846 -2.086 . . . . 0.0 113.512 175.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 47.3 t -47.95 -58.1 4.86 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.271 2.036 . . . . 0.0 111.901 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp -88.58 -40.03 13.67 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.146 179.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.68 -31.67 45.74 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 122.994 0.331 . . . . 0.0 112.854 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 50.7 mmtt -77.05 14.53 0.85 Allowed 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.69 32.87 85.64 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 123.958 0.789 . . . . 0.0 112.091 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.411 ' CA ' ' HA ' ' A' ' 72' ' ' VAL . . . -99.74 179.2 30.21 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 122.091 0.828 . . . . 0.0 113.168 178.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -146.8 153.67 40.46 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 123.218 1.485 . . . . 0.0 111.719 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.1 m -67.48 131.68 46.15 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.702 -1.249 . . . . 0.0 113.196 172.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -130.44 148.87 71.66 Favored Pre-proline 0 N--CA 1.452 -0.366 0 CA-C-O 121.65 0.738 . . . . 0.0 111.594 178.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -67.86 152.28 77.45 Favored 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.584 2.189 . . . . 0.0 111.405 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.634 HD23 ' HG3' ' A' ' 69' ' ' LYS . 12.9 mt -63.49 -18.96 64.34 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 176.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -81.34 -12.7 58.94 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.724 0.81 . . . . 0.0 111.399 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -94.19 136.09 34.86 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 120.965 -1.085 . . . . 0.0 110.444 176.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -86.19 123.2 31.21 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.986 176.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -169.74 -176.86 2.5 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.48 0.712 . . . . 0.0 111.156 178.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -97.4 109.02 21.86 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.611 0.764 . . . . 0.0 112.837 174.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -113.05 137.51 51.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.133 0.968 . . . . 0.0 110.987 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -83.28 145.34 29.15 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.278 -0.969 . . . . 0.0 111.53 176.237 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.404 ' N ' HD13 ' A' ' 57' ' ' LEU . 40.9 mm-40 -66.75 -42.59 85.95 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.594 0.711 . . . . 0.0 112.776 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.48 -32.53 64.35 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.474 -0.766 . . . . 0.0 111.869 177.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -78.22 -39.5 40.27 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.409 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.5 p -53.18 -32.62 48.81 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 124.721 1.209 . . . . 0.0 112.0 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.22 -30.28 64.44 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 175.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.1 p -61.36 -51.45 68.77 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 123.39 0.676 . . . . 0.0 111.665 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.4 t -66.23 -33.91 76.82 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.55 0.34 . . . . 0.0 110.117 -178.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.42 -178.92 27.99 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 123.291 1.495 . . . . 0.0 112.155 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -64.14 154.01 35.98 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.208 -1.172 . . . . 0.0 111.361 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.588 ' HA2' HD11 ' A' ' 50' ' ' LEU . . . 72.21 8.84 71.09 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.136 -0.554 . . . . 0.0 113.745 -178.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -143.06 157.24 44.71 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.048 0.939 . . . . 0.0 110.604 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.634 ' HG3' HD23 ' A' ' 50' ' ' LEU . 5.6 mtmp? -128.53 120.65 27.17 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.384 0.674 . . . . 0.0 111.001 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.3 t -80.15 102.09 9.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.212 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.19 168.26 14.14 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 175.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.411 ' HA ' ' CA ' ' A' ' 45' ' ' GLY . 8.0 p -128.43 144.44 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 C-N-CA 123.763 0.825 . . . . 0.0 111.237 177.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 23.8 m95 -121.04 177.06 5.27 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.89 0.852 . . . . 0.0 111.786 175.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.466 HD12 ' N ' ' A' ' 74' ' ' LEU . 3.1 mp -112.8 -4.01 14.09 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.113 178.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.6 m170 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 115.583 -2.151 . . . . 0.0 111.214 179.714 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 120.949 0.404 . . . . 0.0 110.02 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -103.48 -37.63 7.5 Favored 'General case' 0 C--O 1.212 -0.883 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.418 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -46.26 -56.04 6.32 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 121.411 -0.806 . . . . 0.0 110.99 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.9 -23.88 21.97 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.634 0 CA-C-O 121.054 0.454 . . . . 0.0 111.681 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.9 t -64.66 -35.13 80.04 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 121.516 0.674 . . . . 0.0 111.203 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.497 ' HD3' ' CD2' ' A' ' 24' ' ' TYR . 0.1 OUTLIER -97.23 -13.75 21.83 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 121.811 -0.556 . . . . 0.0 111.602 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.2 29.84 7.33 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 119.018 -0.879 . . . . 0.0 112.621 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.441 ' CD2' ' HB2' ' A' ' 6' ' ' LYS . 57.4 m-85 -85.38 173.89 9.96 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.374 0.587 . . . . 0.0 111.389 179.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.2 131.71 7.3 Favored Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.644 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.8 m -83.73 132.18 34.87 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 122.608 -0.348 . . . . 0.0 111.134 179.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.0 mt -151.24 154.66 34.11 Favored Pre-proline 0 C--O 1.199 -1.555 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -68.27 137.54 40.47 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.84 3.027 . . . . 0.0 111.626 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.405 ' CG ' HG11 ' A' ' 30' ' ' VAL . 87.2 mt-30 -46.82 -31.27 2.93 Favored 'General case' 0 C--O 1.21 -0.981 0 C-N-CA 123.111 0.564 . . . . 0.0 110.437 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.7 t -57.78 -43.95 85.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 121.782 -0.574 . . . . 0.0 112.368 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -86.4 -33.66 20.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.548 0.69 . . . . 0.0 112.117 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.5 t -90.63 125.22 60.2 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-O 121.498 0.666 . . . . 0.0 111.345 179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.47 148.93 74.13 Favored 'Trans proline' 0 N--CA 1.455 -0.76 0 C-N-CA 123.024 2.482 . . . . 0.0 111.712 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -14.59 6.15 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 123.054 0.541 . . . . 0.0 111.844 177.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -85.82 -23.71 27.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 122.84 0.456 . . . . 0.0 112.116 178.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.405 ' HB1' ' H ' ' A' ' 33' ' ' ASP . . . -98.2 -25.41 14.9 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 122.74 0.416 . . . . 0.0 111.114 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.523 ' HD3' HG21 ' A' ' 30' ' ' VAL . 63.0 mtt180 -46.9 123.44 5.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.344 0.658 . . . . 0.0 110.3 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 20.0 mt -107.99 177.07 4.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.343 0.592 . . . . 0.0 110.406 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.8 m -133.04 36.36 3.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.816 0.817 . . . . 0.0 111.341 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.497 ' CD2' ' HD3' ' A' ' 6' ' ' LYS . 11.3 m-85 -71.54 -18.35 62.27 Favored 'General case' 0 C--O 1.205 -1.259 0 O-C-N 121.716 -0.615 . . . . 0.0 110.74 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 66.9 82.79 0.12 Allowed Glycine 0 C--O 1.22 -0.731 0 CA-C-O 122.83 1.239 . . . . 0.0 111.728 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 178.87 26.46 0.04 OUTLIER Glycine 0 C--O 1.22 -0.726 0 O-C-N 120.545 -1.562 . . . . 0.0 113.245 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 86.5 m -129.75 149.97 51.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.595 0.358 . . . . 0.0 111.477 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.4 p -63.97 -39.83 95.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.189 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.9 p -112.39 -75.22 0.61 Allowed 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 121.358 0.599 . . . . 0.0 110.627 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.523 HG21 ' HD3' ' A' ' 21' ' ' ARG . 7.1 p -152.99 134.11 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-O 123.387 1.565 . . . . 0.0 111.057 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 2.0 m -69.83 138.05 52.28 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 120.124 -1.61 . . . . 0.0 111.513 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.854 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.6 OUTLIER -114.12 148.77 36.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.151 0.501 . . . . 0.0 111.084 178.766 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.405 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 8.5 t70 -92.25 106.33 18.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.163 0.506 . . . . 0.0 110.848 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 mt -66.87 -35.0 79.03 Favored 'General case' 0 C--O 1.219 -0.548 0 O-C-N 121.849 -0.532 . . . . 0.0 110.879 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.7 t -62.66 -38.71 91.38 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 122.58 0.352 . . . . 0.0 111.542 178.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -80.15 -36.23 35.43 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 122.762 0.425 . . . . 0.0 110.879 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.854 HD11 ' SG ' ' A' ' 32' ' ' CYS . 72.7 mt -66.4 -58.81 4.49 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.304 0.574 . . . . 0.0 110.491 -179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.504 HG21 ' OG ' ' A' ' 63' ' ' SER . 60.3 p -137.67 -176.3 4.37 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 122.394 1.093 . . . . 0.0 111.232 -179.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -119.96 2.17 13.25 Favored Glycine 0 C--O 1.225 -0.456 0 O-C-N 121.036 -1.04 . . . . 0.0 113.0 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -58.28 -51.79 68.31 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.535 0.683 . . . . 0.0 109.276 -176.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -38.27 79.59 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.79 179.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.82 -42.79 92.12 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -79.58 9.43 4.98 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.675 0.39 . . . . 0.0 111.658 178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 78.17 38.85 24.91 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 112.337 -0.305 . . . . 0.0 112.337 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -106.94 173.37 19.09 Favored Glycine 0 N--CA 1.451 -0.35 0 O-C-N 122.591 -0.359 . . . . 0.0 112.506 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -151.71 157.32 41.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 122.158 0.98 . . . . 0.0 111.639 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 t -71.95 133.39 45.34 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 121.409 -0.807 . . . . 0.0 111.612 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -133.84 147.74 65.5 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-O 122.021 0.915 . . . . 0.0 111.65 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.28 156.19 66.6 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.943 2.429 . . . . 0.0 112.111 179.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.464 ' CD2' ' HG2' ' A' ' 69' ' ' LYS . 18.3 mt -60.25 -16.44 33.81 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.609 178.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -80.69 -14.38 58.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.425 0.631 . . . . 0.0 111.49 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -90.93 147.37 23.17 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 121.378 -0.826 . . . . 0.0 110.746 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -106.68 122.07 45.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.357 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -174.74 164.87 3.64 Favored 'General case' 0 C--O 1.2 -1.525 0 C-N-CA 122.739 0.415 . . . . 0.0 111.877 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm -75.25 113.4 12.57 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.637 -0.664 . . . . 0.0 110.296 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -130.21 132.57 46.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 122.188 0.994 . . . . 0.0 110.842 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 tp -80.96 132.29 35.39 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 121.084 -1.01 . . . . 0.0 110.588 179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -55.88 -39.3 71.34 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 122.154 -0.341 . . . . 0.0 111.575 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.77 70.21 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.691 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -78.68 -36.72 43.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 122.411 0.285 . . . . 0.0 111.51 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 18.6 m -51.96 -37.79 54.24 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 123.411 0.684 . . . . 0.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.27 -28.36 58.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.504 ' OG ' HG21 ' A' ' 38' ' ' THR . 15.9 m -56.93 -58.27 8.9 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.237 0.615 . . . . 0.0 110.805 179.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.3 m -60.16 -37.97 81.76 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.137 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 119.31 -156.41 15.75 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-O 122.173 0.874 . . . . 0.0 111.871 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.5 pttt -89.25 133.14 34.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 O-C-N 121.614 -0.933 . . . . 0.0 111.141 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.89 13.74 60.38 Favored Glycine 0 C--O 1.227 -0.305 0 C-N-CA 121.188 -0.529 . . . . 0.0 113.032 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -144.56 150.0 36.77 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.865 0.466 . . . . 0.0 111.034 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.464 ' HG2' ' CD2' ' A' ' 50' ' ' LEU . 16.5 mmtp -127.95 122.03 31.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.434 0.635 . . . . 0.0 111.456 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -78.47 110.51 13.61 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.822 -0.549 . . . . 0.0 111.431 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 95.6 m -99.46 162.61 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.509 0.671 . . . . 0.0 111.509 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.1 p -119.18 144.55 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.816 -0.553 . . . . 0.0 110.971 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 29.6 m95 -127.09 178.94 5.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.544 0.688 . . . . 0.0 111.056 178.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.591 ' N ' HD23 ' A' ' 74' ' ' LEU . 1.7 pt? -134.38 162.71 31.45 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.42 0.688 . . . . 0.0 111.177 -179.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 C--O 1.246 0.874 0 CA-C-O 117.47 -1.252 . . . . 0.0 112.139 177.843 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . 0.464 HD22 ' N ' ' A' ' 2' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.217 -0.634 0 CA-C-O 118.359 -0.829 . . . . 0.0 108.836 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.464 ' N ' HD22 ' A' ' 1' ' ' ASN . 23.8 mm-40 -122.18 -34.75 3.26 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 124.27 0.981 . . . . 0.0 110.475 -177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 1.1 m -50.9 -48.05 60.6 Favored 'General case' 0 C--N 1.342 0.25 0 O-C-N 121.644 -0.66 . . . . 0.0 111.853 177.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.6 p -57.17 -29.96 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 t -71.17 -29.59 65.38 Favored 'General case' 0 C--O 1.23 0.043 0 C-N-CA 124.252 1.021 . . . . 0.0 111.247 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.473 ' HG3' ' CE1' ' A' ' 24' ' ' TYR . 0.0 OUTLIER -94.02 -11.81 29.98 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 174.452 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.98 45.76 4.7 Favored Glycine 0 C--O 1.224 -0.504 0 O-C-N 124.339 1.025 . . . . 0.0 111.693 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.455 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 54.0 m-85 -111.21 163.75 13.59 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.401 1.101 . . . . 0.0 111.369 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -115.94 136.08 12.66 Favored Glycine 0 CA--C 1.522 0.504 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 83.3 m -80.56 125.36 29.89 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.621 176.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.633 HD13 ' OD2' ' A' ' 15' ' ' ASP . 48.7 mt -137.7 155.94 74.84 Favored Pre-proline 0 C--O 1.214 -0.799 0 O-C-N 124.01 0.819 . . . . 0.0 112.078 179.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -65.1 140.81 67.05 Favored 'Trans proline' 0 C--O 1.214 -0.697 0 C-N-CA 124.254 3.303 . . . . 0.0 110.255 178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.589 ' HA ' HG11 ' A' ' 30' ' ' VAL . 1.0 OUTLIER -49.5 -31.0 9.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.959 0.903 . . . . 0.0 112.745 176.68 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.0 t -66.13 -44.92 82.84 Favored 'General case' 0 C--O 1.224 -0.289 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 173.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.633 ' OD2' HD13 ' A' ' 11' ' ' LEU . 25.3 t70 -72.41 -44.97 61.71 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.571 0.748 . . . . 0.0 112.475 175.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' SG ' ' HB3' ' A' ' 20' ' ' ALA . 13.9 t -89.51 124.68 63.67 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 121.444 -0.785 . . . . 0.0 112.278 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -64.01 149.27 90.87 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.694 2.263 . . . . 0.0 111.206 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -54.2 -18.15 3.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -79.34 -32.66 43.35 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.968 0.907 . . . . 0.0 113.198 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.408 ' HB3' ' SG ' ' A' ' 16' ' ' CYS . . . -90.02 -23.2 21.55 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.686 177.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.656 ' HG2' HG21 ' A' ' 30' ' ' VAL . 95.4 mtt180 -45.48 116.49 1.17 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.938 0.895 . . . . 0.0 110.701 178.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.587 HD12 ' HB3' ' A' ' 31' ' ' CYS . 15.1 mt -95.52 177.27 5.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 122.339 1.066 . . . . 0.0 109.267 -178.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.1 m -130.4 28.68 4.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.192 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.473 ' CE1' ' HG3' ' A' ' 6' ' ' LYS . 37.7 m-85 -70.4 -19.36 63.01 Favored 'General case' 0 C--O 1.211 -0.936 0 O-C-N 121.891 -0.505 . . . . 0.0 111.525 177.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.89 78.87 0.26 Allowed Glycine 0 CA--C 1.527 0.839 0 CA-C-O 124.19 1.995 . . . . 0.0 111.555 178.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.29 27.88 0.09 OUTLIER Glycine 0 C--O 1.218 -0.86 0 O-C-N 118.968 -2.489 . . . . 0.0 112.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.548 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 84.5 m -135.62 143.48 45.58 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 117.863 0.831 . . . . 0.0 111.125 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.8 m -61.6 -33.99 74.86 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.519 1.137 . . . . 0.0 111.531 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 54.3 p -113.23 -76.0 0.59 Allowed 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 123.184 0.593 . . . . 0.0 111.011 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.656 HG21 ' HG2' ' A' ' 21' ' ' ARG . 8.6 p -151.69 145.19 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 123.255 1.502 . . . . 0.0 111.261 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.587 ' HB3' HD12 ' A' ' 22' ' ' LEU . 1.9 m -81.17 137.04 35.93 Favored 'General case' 0 C--N 1.319 -0.751 0 O-C-N 120.07 -1.644 . . . . 0.0 110.303 175.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -112.07 141.08 46.18 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 123.654 0.782 . . . . 0.0 112.165 176.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.577 ' HB2' HD21 ' A' ' 22' ' ' LEU . 17.7 t0 -83.57 104.61 13.84 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.904 0.859 . . . . 0.0 110.434 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.487 HD22 ' HE2' ' A' ' 41' ' ' LYS . 60.7 mt -66.08 -32.61 74.17 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 121.432 -0.792 . . . . 0.0 110.992 177.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.1 m -66.05 -33.83 76.69 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 119.544 -1.973 . . . . 0.0 112.45 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -80.97 -35.62 31.88 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.075 0.55 . . . . 0.0 112.208 177.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.0 mp -89.31 -68.56 0.77 Allowed 'General case' 0 C--O 1.224 -0.285 0 CA-C-O 121.392 0.615 . . . . 0.0 109.389 -178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.1 t -172.11 147.1 2.02 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 122.811 1.291 . . . . 0.0 112.992 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -104.91 31.3 8.73 Favored Glycine 0 C--O 1.212 -1.239 0 CA-C-O 117.986 -1.452 . . . . 0.0 112.405 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 53.9 t -52.36 -54.5 30.99 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 120.402 2.101 . . . . 0.0 111.535 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.487 ' HE2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -85.15 -37.6 20.0 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 123.747 0.819 . . . . 0.0 112.087 177.679 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -62.48 -37.88 95.41 Favored Glycine 0 C--O 1.219 -0.808 0 N-CA-C 111.376 -0.689 . . . . 0.0 111.376 -177.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -78.87 15.93 0.99 Allowed 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.971 0.908 . . . . 0.0 112.508 174.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 65.89 30.54 77.33 Favored Glycine 0 CA--C 1.529 0.932 0 O-C-N 121.386 -0.821 . . . . 0.0 112.078 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.62 166.4 54.14 Favored Glycine 0 CA--C 1.524 0.653 0 O-C-N 122.033 -0.687 . . . . 0.0 112.388 177.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -144.44 154.73 43.25 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.656 1.217 . . . . 0.0 111.206 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.4 109.09 4.01 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.573 -0.704 . . . . 0.0 112.491 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -106.81 148.7 37.38 Favored Pre-proline 0 CA--C 1.533 0.296 0 CA-C-O 121.805 0.812 . . . . 0.0 111.993 177.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -67.14 153.54 77.21 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.55 2.167 . . . . 0.0 110.99 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.422 HD22 ' HE3' ' A' ' 69' ' ' LYS . 18.5 mt -60.21 -16.45 33.5 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 174.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -78.25 -18.21 55.65 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.098 0.959 . . . . 0.0 112.258 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -87.38 145.65 26.22 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.455 -1.403 . . . . 0.0 110.822 176.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -98.95 121.96 41.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.886 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -174.17 161.27 3.52 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 123.832 0.853 . . . . 0.0 111.202 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.19 110.52 6.7 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 122.702 0.401 . . . . 0.0 110.748 177.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.442 ' OE1' ' HB3' ' A' ' 61' ' ' SER . 0.8 OUTLIER -125.11 133.57 52.81 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.619 1.199 . . . . 0.0 110.112 178.191 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.531 HD23 ' HG2' ' A' ' 60' ' ' GLU . 22.1 tp -82.48 129.21 34.86 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 171.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -51.67 -40.01 59.28 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.441 -0.787 . . . . 0.0 113.002 177.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.45 -24.75 67.73 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.273 1.029 . . . . 0.0 111.998 178.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.531 ' HG2' HD23 ' A' ' 57' ' ' LEU . 27.2 mm-40 -91.17 -42.5 10.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.662 1.185 . . . . 0.0 113.489 176.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.442 ' HB3' ' OE1' ' A' ' 56' ' ' GLU . 24.8 p -52.24 -26.68 12.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.739 0.699 . . . . 0.0 112.82 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.21 -37.27 85.16 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 175.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.5 t -67.33 -50.26 60.77 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 124.186 0.994 . . . . 0.0 111.635 178.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 10.8 m -51.71 -38.32 54.65 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.667 0.387 . . . . 0.0 112.043 178.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 121.08 156.36 9.78 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.808 1.227 . . . . 0.0 111.036 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -51.68 129.97 27.3 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 121.168 -1.195 . . . . 0.0 110.992 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.71 12.14 64.79 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 114.448 0.539 . . . . 0.0 114.448 -177.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -135.63 157.21 47.43 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 124.101 0.961 . . . . 0.0 110.445 179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.422 ' HE3' HD22 ' A' ' 50' ' ' LEU . 73.7 mttt -135.17 120.58 19.14 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 124.834 1.253 . . . . 0.0 110.34 -178.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.78 98.84 0.56 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.447 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 65.8 m -97.31 159.85 14.68 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 122.738 1.256 . . . . 0.0 111.351 176.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -111.97 145.29 18.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 O-C-N 121.522 -0.736 . . . . 0.0 110.92 177.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.9 m95 -129.24 -3.17 5.0 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 117.609 -1.186 . . . . 0.0 113.889 178.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -24.79 121.25 0.05 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.826 1.65 . . . . 0.0 112.337 173.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 116.363 -1.78 . . . . 0.0 111.175 179.792 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -124.16 -24.85 4.26 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.559 0.744 . . . . 0.0 112.73 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.581 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 68.3 m -51.32 -60.16 3.43 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.732 1.213 . . . . 0.0 110.102 178.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -57.54 -33.71 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 175.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.0 t -64.79 -26.87 68.53 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.983 1.313 . . . . 0.0 111.793 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.54 -10.65 23.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.505 174.078 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 86.15 30.83 21.64 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 124.32 0.962 . . . . 0.0 113.666 -177.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -82.39 165.32 20.39 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.249 1.024 . . . . 0.0 112.776 174.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -110.2 123.2 6.59 Favored Glycine 0 CA--C 1.526 0.757 0 C-N-CA 124.609 1.1 . . . . 0.0 111.721 178.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.7 m -72.85 131.53 42.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.636 -0.92 . . . . 0.0 111.878 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.5 mt -140.99 161.84 51.54 Favored Pre-proline 0 CA--C 1.535 0.369 0 O-C-N 124.007 0.817 . . . . 0.0 111.107 176.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.98 142.27 50.9 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.364 2.043 . . . . 0.0 111.067 172.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -54.45 -20.39 7.47 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 175.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 t -70.24 -46.81 63.67 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.049 1.34 . . . . 0.0 112.525 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.29 -39.08 49.25 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.334 1.053 . . . . 0.0 111.076 176.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.8 t -86.68 110.92 36.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 O-C-N 120.481 -1.387 . . . . 0.0 112.024 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -61.24 150.29 85.34 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.911 2.407 . . . . 0.0 110.434 -178.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -49.97 -23.68 2.15 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 176.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -72.46 -42.49 64.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.465 1.906 . . . . 0.0 111.818 175.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.26 -20.6 31.92 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 117.337 -1.316 . . . . 0.0 113.049 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -52.14 106.39 0.15 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.282 1.401 . . . . 0.0 111.802 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.703 HD21 ' HB2' ' A' ' 33' ' ' ASP . 17.0 mt -90.19 172.7 8.61 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.826 0.822 . . . . 0.0 111.259 -179.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 m -123.72 27.36 7.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.586 1.554 . . . . 0.0 112.786 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.581 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 11.8 m-85 -71.75 -15.81 62.19 Favored 'General case' 0 C--O 1.212 -0.879 0 C-N-CA 123.371 0.668 . . . . 0.0 111.489 178.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.99 80.43 0.09 OUTLIER Glycine 0 N--CA 1.468 0.818 0 CA-C-O 123.63 1.684 . . . . 0.0 112.432 175.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -178.39 28.27 0.06 OUTLIER Glycine 0 C--O 1.223 -0.587 0 O-C-N 120.509 -1.583 . . . . 0.0 114.904 -176.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 52.0 m -133.7 159.71 39.72 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 123.54 0.736 . . . . 0.0 110.981 175.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.2 m -52.39 -48.59 65.54 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 124.175 0.99 . . . . 0.0 112.927 -179.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.58 -61.52 1.45 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.34 1.456 . . . . 0.0 110.557 -178.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.3 p -144.35 153.27 15.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 121.682 0.753 . . . . 0.0 111.294 176.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 82.9 m -90.77 136.5 33.03 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.741 0.816 . . . . 0.0 109.109 171.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.582 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.3 OUTLIER -114.29 137.37 51.88 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.995 1.318 . . . . 0.0 111.821 174.904 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.703 ' HB2' HD21 ' A' ' 22' ' ' LEU . 19.5 t0 -81.71 101.52 10.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.027 -179.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 mt -62.75 -35.53 80.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 118.217 -0.897 . . . . 0.0 111.954 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.3 t -61.63 -38.94 89.51 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.524 1.53 . . . . 0.0 111.522 176.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -80.07 -36.66 35.26 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 177.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.582 HD11 ' SG ' ' A' ' 32' ' ' CYS . 55.7 mt -61.63 -60.29 3.9 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.336 1.054 . . . . 0.0 109.945 178.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 34.2 p -148.93 164.36 34.75 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.178 0.989 . . . . 0.0 112.502 -175.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -80.67 -23.63 59.79 Favored Glycine 0 CA--C 1.529 0.96 0 O-C-N 119.954 -1.716 . . . . 0.0 113.782 177.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.1 t -47.8 -55.48 9.58 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.678 1.739 . . . . 0.0 113.09 -176.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.1 mmtp -71.31 -40.2 70.97 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.32 -38.37 61.96 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 123.44 0.543 . . . . 0.0 113.372 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 42.3 mttm -80.15 11.84 3.22 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.943 1.697 . . . . 0.0 114.061 174.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 60.36 30.78 72.09 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.594 1.092 . . . . 0.0 113.276 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.64 163.7 40.7 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 123.507 0.575 . . . . 0.0 112.69 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -125.87 144.7 50.56 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.469 1.507 . . . . 0.0 111.115 -178.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.3 t -69.25 128.88 38.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 121.132 -0.98 . . . . 0.0 110.332 176.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -130.74 146.8 63.53 Favored Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 121.45 -0.781 . . . . 0.0 111.654 177.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -66.06 157.86 57.34 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 122.368 2.045 . . . . 0.0 110.428 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.3 mt -62.08 -22.2 65.58 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -77.86 -13.43 59.89 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.646 1.578 . . . . 0.0 113.078 174.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -87.49 135.46 33.34 Favored 'General case' 0 C--N 1.343 0.308 0 O-C-N 120.429 -1.419 . . . . 0.0 110.0 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -99.94 123.51 44.26 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.238 1.415 . . . . 0.0 110.371 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -165.65 178.55 6.58 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 125.275 1.43 . . . . 0.0 109.805 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -80.42 110.42 15.85 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 121.446 -0.784 . . . . 0.0 110.302 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -121.9 133.31 54.86 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 124.452 1.101 . . . . 0.0 111.35 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.561 HD23 ' OE1' ' A' ' 60' ' ' GLU . 13.3 tp -88.44 133.63 34.07 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.914 -1.116 . . . . 0.0 109.344 173.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 pm0 -50.3 -40.38 48.41 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.029 1.732 . . . . 0.0 113.813 172.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.6 -25.75 66.77 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.791 1.236 . . . . 0.0 112.381 176.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.561 ' OE1' HD23 ' A' ' 57' ' ' LEU . 1.1 mp0 -94.13 -28.49 15.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.233 1.013 . . . . 0.0 112.718 174.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.0 t -51.66 -38.5 55.19 Favored 'General case' 0 CA--C 1.52 -0.198 0 C-N-CA 125.658 1.583 . . . . 0.0 111.638 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.14 -44.13 67.52 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.289 1.436 . . . . 0.0 113.474 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.0 t -44.58 -55.96 4.73 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.138 1.775 . . . . 0.0 112.753 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 18.0 m -77.12 -58.48 3.26 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.485 172.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 36.87 -146.07 0.08 OUTLIER Glycine 0 N--CA 1.472 1.057 0 C-N-CA 128.504 2.954 . . . . 0.0 112.255 -175.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 pttt 42.05 42.83 2.53 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 121.142 2.471 . . . . 0.0 117.174 172.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 86.26 17.05 61.47 Favored Glycine 0 CA--C 1.542 1.726 0 N-CA-C 115.36 0.904 . . . . 0.0 115.36 -174.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 -142.16 152.55 43.3 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 128.042 2.537 . . . . 0.0 109.957 -177.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -129.09 160.84 31.54 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.842 -1.161 . . . . 0.0 109.986 176.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 47.6 t -97.91 107.41 19.88 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 123.394 0.678 . . . . 0.0 110.779 178.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.41 152.1 23.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.167 0.508 . . . . 0.0 110.978 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.1 m -117.93 146.8 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 124.093 0.957 . . . . 0.0 110.986 176.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.7 m95 -107.88 -73.34 0.69 Allowed 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.112 0.965 . . . . 0.0 111.771 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.68 175.41 4.23 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.034 0.921 . . . . 0.0 110.672 177.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 p80 . . . . . 0 C--O 1.253 1.264 0 CA-C-O 116.639 -1.648 . . . . 0.0 111.798 175.648 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -117.71 -32.41 4.85 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.337 -173.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -50.16 -48.22 54.02 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.409 0.683 . . . . 0.0 111.823 176.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.29 -33.91 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 124.78 1.232 . . . . 0.0 113.21 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 t -68.39 -28.18 66.87 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.138 1.375 . . . . 0.0 112.066 177.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -96.57 -5.69 38.62 Favored 'General case' 0 C--N 1.341 0.231 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 172.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 76.04 40.84 28.92 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.862 0.755 . . . . 0.0 113.533 -176.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.51 ' CE2' ' CE2' ' A' ' 24' ' ' TYR . 57.0 m-85 -94.9 167.21 11.56 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.334 1.054 . . . . 0.0 112.918 172.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -113.51 127.5 7.89 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.437 1.018 . . . . 0.0 111.627 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 66.6 m -72.41 134.29 45.33 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 121.782 -0.834 . . . . 0.0 111.865 171.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 33.0 mt -142.73 163.47 38.38 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.257 175.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.504 ' HA ' HG21 ' A' ' 29' ' ' THR . 58.2 Cg_endo -68.55 137.51 39.43 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.116 2.544 . . . . 0.0 112.203 172.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -52.75 -17.1 1.17 Allowed 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -46.44 56.49 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.342 1.857 . . . . 0.0 112.041 171.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -82.05 -35.98 28.18 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.581 1.152 . . . . 0.0 112.107 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.5 t -87.26 109.47 25.77 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.757 -1.215 . . . . 0.0 112.08 -179.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -65.06 150.66 87.64 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.933 2.422 . . . . 0.0 111.509 -176.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -55.05 -18.38 5.22 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -78.74 -33.16 46.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.525 1.53 . . . . 0.0 112.931 176.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -93.81 -17.15 23.41 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.52 1.528 . . . . 0.0 112.666 179.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -51.75 109.48 0.36 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.09 0.956 . . . . 0.0 111.873 174.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 36.9 mt -86.03 170.54 12.16 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.915 0.864 . . . . 0.0 111.882 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.3 t -120.13 22.05 11.56 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.961 1.305 . . . . 0.0 112.224 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.51 ' CE2' ' CE2' ' A' ' 8' ' ' PHE . 60.4 m-85 -70.29 -19.68 63.08 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 175.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.26 73.04 0.5 Allowed Glycine 0 N--CA 1.471 0.985 0 O-C-N 120.608 -1.308 . . . . 0.0 113.684 177.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -167.02 30.19 0.19 Allowed Glycine 0 N--CA 1.464 0.507 0 O-C-N 120.407 -1.643 . . . . 0.0 114.163 -176.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 59.9 m -130.55 163.22 27.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.195 0.998 . . . . 0.0 112.109 178.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.0 m -59.08 -31.43 68.88 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.837 1.255 . . . . 0.0 113.198 -178.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.504 HG21 ' HA ' ' A' ' 12' ' ' PRO . 1.6 t -144.75 -55.22 0.33 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.605 1.162 . . . . 0.0 111.933 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 29' ' ' THR . 5.3 p -146.27 151.24 14.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 CA-C-O 122.357 1.075 . . . . 0.0 110.945 174.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.438 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 14.2 m -87.83 139.11 30.85 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 124.233 1.013 . . . . 0.0 108.646 170.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.422 ' SG ' HD11 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -117.4 136.52 53.12 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 123.669 0.788 . . . . 0.0 112.042 174.726 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -78.49 102.77 8.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.849 0.833 . . . . 0.0 111.672 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.9 mt -58.34 -38.2 76.68 Favored 'General case' 0 C--O 1.221 -0.44 0 O-C-N 121.686 -0.634 . . . . 0.0 111.642 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 t -61.52 -37.31 83.26 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.343 1.057 . . . . 0.0 111.819 178.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.0 mtpt -77.48 -41.64 38.75 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 175.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.422 HD11 ' SG ' ' A' ' 32' ' ' CYS . 50.5 mt -63.53 -59.78 4.19 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.46 0.704 . . . . 0.0 111.218 177.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -172.83 144.61 1.35 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 123.324 1.535 . . . . 0.0 113.774 -174.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -79.68 7.97 51.52 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 116.874 -2.07 . . . . 0.0 115.597 174.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 13.9 t -56.95 -55.34 35.92 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 122.511 3.155 . . . . 0.0 111.341 -165.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.65 -28.98 56.22 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.87 1.268 . . . . 0.0 113.65 171.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -78.83 -27.05 57.43 Favored Glycine 0 CA--C 1.535 1.302 0 O-C-N 121.309 -0.87 . . . . 0.0 114.91 -173.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.78 9.08 12.76 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.187 2.595 . . . . 0.0 112.713 173.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 83.58 31.21 27.86 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.617 1.58 . . . . 0.0 114.206 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -113.79 179.91 18.93 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.332 1.066 . . . . 0.0 113.112 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -150.52 157.13 42.66 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.807 0.843 . . . . 0.0 111.152 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.0 t -63.5 126.86 28.88 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.046 -1.034 . . . . 0.0 110.807 174.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -124.92 152.89 70.75 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.17 0.988 . . . . 0.0 111.357 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.18 156.76 46.68 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.356 2.037 . . . . 0.0 111.524 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.0 mt -62.52 -24.42 67.49 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 178.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -71.8 -19.52 61.99 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.891 1.276 . . . . 0.0 113.747 172.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -79.24 127.47 32.09 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.981 -1.074 . . . . 0.0 110.522 173.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -91.13 117.62 29.76 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 123.715 0.806 . . . . 0.0 111.498 172.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -164.66 174.39 10.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.64 1.176 . . . . 0.0 110.988 176.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 tptt -72.93 124.68 25.92 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 121.44 -0.788 . . . . 0.0 109.236 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -123.79 142.16 51.36 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 124.808 1.243 . . . . 0.0 110.214 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -92.75 152.36 19.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.852 0.834 . . . . 0.0 110.355 174.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 mp0 -73.24 -38.6 65.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.389 -0.819 . . . . 0.0 110.648 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.18 58.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.317 0.647 . . . . 0.0 112.638 177.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -82.48 -43.16 17.55 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.909 0.884 . . . . 0.0 111.111 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.2 p -58.25 -31.88 67.82 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 119.959 -1.713 . . . . 0.0 112.096 178.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.75 -38.24 64.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.975 1.31 . . . . 0.0 113.341 174.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -57.96 -49.14 77.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.72 1.608 . . . . 0.0 114.107 -176.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 m -75.73 -59.16 2.87 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 169.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 38.8 -143.6 0.3 Allowed Glycine 0 CA--C 1.527 0.826 0 C-N-CA 126.077 1.799 . . . . 0.0 112.017 -175.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? 48.23 35.56 5.63 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.02 1.859 . . . . 0.0 116.02 171.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 89.26 21.19 42.4 Favored Glycine 0 CA--C 1.538 1.486 0 N-CA-C 115.174 0.83 . . . . 0.0 115.174 -172.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -136.78 157.0 47.77 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.342 2.257 . . . . 0.0 111.373 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 42.7 mttt -134.49 142.17 46.97 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 126.399 1.88 . . . . 0.0 109.724 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.4 m -86.8 115.45 24.23 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 120.823 -1.173 . . . . 0.0 110.015 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 18.3 m -110.41 152.1 26.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.449 0.642 . . . . 0.0 112.155 176.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.2 p -123.66 143.9 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.601 0.761 . . . . 0.0 110.475 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 31.5 m95 -104.06 179.11 4.37 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.465 1.106 . . . . 0.0 110.939 175.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.3 mt -54.84 125.08 18.66 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.254 1.022 . . . . 0.0 110.727 167.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.1 m170 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 115.738 -2.077 . . . . 0.0 112.173 174.551 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 5.3 p30 . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -120.38 -30.58 4.54 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.513 1.133 . . . . 0.0 112.033 -173.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.588 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 86.0 m -51.96 -46.71 64.88 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.514 1.126 . . . . 0.0 111.4 176.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.81 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.799 1.24 . . . . 0.0 112.023 176.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.2 t -67.63 -23.89 65.4 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.242 1.017 . . . . 0.0 112.093 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.444 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.3 OUTLIER -99.32 -2.12 37.19 Favored 'General case' 0 C--N 1.34 0.182 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 171.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.18 31.92 58.93 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 118.578 -1.124 . . . . 0.0 113.179 -178.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' A' ' 6' ' ' LYS . 45.4 m-85 -88.01 166.74 14.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.275 1.43 . . . . 0.0 112.636 174.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.11 129.25 8.01 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 125.021 1.296 . . . . 0.0 110.835 -178.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 60.4 m -69.16 124.8 24.77 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.066 0.546 . . . . 0.0 111.578 171.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 36.7 mt -131.57 162.73 54.39 Favored Pre-proline 0 CA--C 1.538 0.507 0 O-C-N 124.084 0.865 . . . . 0.0 110.861 174.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.47 138.51 35.73 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 123.003 2.468 . . . . 0.0 110.576 172.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -52.51 -18.38 1.67 Allowed 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.1 t -74.5 -45.33 46.61 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.63 1.972 . . . . 0.0 112.533 171.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -74.99 -43.16 55.51 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.357 1.063 . . . . 0.0 110.971 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.7 t -84.82 119.23 72.48 Favored Pre-proline 0 C--O 1.242 0.698 0 C-N-CA 123.348 0.659 . . . . 0.0 111.906 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.4 148.23 92.86 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.471 2.114 . . . . 0.0 110.869 -178.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -49.98 -28.08 6.33 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 173.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -72.02 -32.84 67.54 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 174.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.38 -17.87 26.49 Favored 'General case' 0 N--CA 1.46 0.064 0 C-N-CA 125.349 1.46 . . . . 0.0 113.539 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.417 ' HG2' HG21 ' A' ' 30' ' ' VAL . 90.4 mtt180 -51.72 105.91 0.13 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 121.479 -0.763 . . . . 0.0 111.443 173.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' ' 31' ' ' CYS . 47.3 mt -84.64 167.33 16.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 122.487 1.137 . . . . 0.0 111.194 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 p -116.59 18.18 15.09 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 125.822 1.649 . . . . 0.0 112.426 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.588 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 51.2 m-85 -66.93 -9.21 35.81 Favored 'General case' 0 C--O 1.211 -0.921 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.17 57.37 19.5 Favored Glycine 0 N--CA 1.472 1.095 0 O-C-N 120.444 -1.41 . . . . 0.0 113.098 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -147.22 23.55 1.57 Allowed Glycine 0 C--O 1.226 -0.404 0 CA-C-O 118.767 -1.018 . . . . 0.0 115.575 -172.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 58.8 m -141.39 143.6 34.04 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 124.216 1.006 . . . . 0.0 111.134 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.3 m -50.24 -43.87 53.17 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.837 1.255 . . . . 0.0 113.37 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.52 -73.49 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 126.508 1.923 . . . . 0.0 110.509 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.417 HG21 ' HG2' ' A' ' 21' ' ' ARG . 9.4 p -148.09 153.8 11.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 123.839 0.856 . . . . 0.0 111.015 177.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.537 ' SG ' ' SG ' ' A' ' 27' ' ' CYS . 88.1 m -91.53 133.94 35.09 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -109.64 138.62 45.73 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.762 1.225 . . . . 0.0 112.038 173.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.614 ' OD2' ' HE2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -81.4 95.95 7.2 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-O 122.912 1.339 . . . . 0.0 114.415 178.953 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.15 -37.31 86.7 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 120.718 -1.239 . . . . 0.0 110.927 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.8 p -66.28 -36.61 83.41 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.008 -1.683 . . . . 0.0 113.263 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.614 ' HE2' ' OD2' ' A' ' 33' ' ' ASP . 15.6 mtmm -80.53 -35.59 34.31 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.361 1.465 . . . . 0.0 113.342 177.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.4 mt -89.95 -75.78 0.44 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.815 1.246 . . . . 0.0 110.71 178.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.9 t -161.72 139.04 8.66 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.032 1.333 . . . . 0.0 112.684 -177.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -112.99 52.88 0.61 Allowed Glycine 0 CA--C 1.521 0.44 0 CA-C-O 118.187 -1.34 . . . . 0.0 112.32 -178.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.406 ' HB2' ' HG2' ' A' ' 60' ' ' GLU . 15.1 t -47.77 -59.92 2.95 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 118.267 1.034 . . . . 0.0 110.257 -179.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.56 -34.84 38.54 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 175.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -71.95 -37.43 60.57 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 124.567 1.08 . . . . 0.0 112.226 -178.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -80.28 8.09 8.17 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.099 1.36 . . . . 0.0 113.809 174.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 88.68 19.27 52.44 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 125.195 1.379 . . . . 0.0 114.069 -177.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -83.39 150.26 26.97 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 125.138 1.351 . . . . 0.0 112.77 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -140.55 145.65 37.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 124.657 1.183 . . . . 0.0 110.322 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 91.4 m -71.77 114.3 9.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.522 0.729 . . . . 0.0 111.912 174.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -117.33 148.72 43.24 Favored Pre-proline 0 C--O 1.241 0.618 0 C-N-CA 124.172 0.989 . . . . 0.0 110.581 -179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.79 152.7 77.22 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 121.86 1.706 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.3 mt -60.61 -18.4 52.87 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.56 -24.27 56.66 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.049 1.739 . . . . 0.0 112.844 171.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -78.26 143.29 37.18 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 119.961 -1.712 . . . . 0.0 110.582 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -102.75 120.72 41.09 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 124.535 1.134 . . . . 0.0 111.371 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.6 p -169.5 173.23 6.57 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.236 1.414 . . . . 0.0 110.943 175.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -76.0 102.26 5.57 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.89 1.276 . . . . 0.0 110.955 177.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -118.73 139.64 51.23 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.49 1.116 . . . . 0.0 110.342 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 17.8 mt -87.92 126.31 34.98 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 123.106 0.563 . . . . 0.0 110.171 176.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -60.62 -39.35 87.87 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.335 0.654 . . . . 0.0 111.816 -178.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.34 -26.57 58.69 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.117 0.967 . . . . 0.0 113.023 175.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.406 ' HG2' ' HB2' ' A' ' 40' ' ' CYS . 7.3 tt0 -88.67 -22.33 23.47 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.225 1.01 . . . . 0.0 112.327 179.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.8 p -54.91 -29.3 55.72 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.968 1.707 . . . . 0.0 112.708 175.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.4 -29.64 49.62 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.328 1.451 . . . . 0.0 113.053 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 66.1 m -55.23 -42.77 73.85 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 174.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 73.8 m -80.37 -36.62 33.72 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 122.821 0.448 . . . . 0.0 111.678 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 110.36 170.39 19.75 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 122.954 1.308 . . . . 0.0 112.514 179.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -56.26 134.87 53.59 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 120.749 -1.442 . . . . 0.0 111.092 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.13 5.4 65.85 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-O 118.977 -0.902 . . . . 0.0 114.054 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -140.99 163.63 32.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.843 2.057 . . . . 0.0 110.225 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -123.9 162.05 24.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.76 1.624 . . . . 0.0 110.151 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -123.7 97.48 5.4 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.566 0.747 . . . . 0.0 110.95 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 93.8 m -97.72 138.67 34.76 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.338 1.055 . . . . 0.0 110.157 -178.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -105.17 145.76 13.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 124.136 0.974 . . . . 0.0 111.369 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.7 m95 -121.13 172.62 7.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 122.139 0.971 . . . . 0.0 110.839 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -59.94 165.8 3.05 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.751 167.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 . . . . . 0 C--O 1.253 1.251 0 CA-C-O 115.598 -2.144 . . . . 0.0 112.972 175.601 . . . . . . . . 0 0 . 1 stop_ save_