data_6d8y_residue ############################ # Computer software used # ############################ 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 6d8y _Structure_validation_residue.Date_analyzed 2019-04-26 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 ' 3' ' ' CYS . . . . . . . . . . . . . 57.0 m . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.86 3.26 10.4 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -171.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp 37.33 -67.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.442 1 C-N-CA 135.624 5.569 . . . . 0.0 113.905 172.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 mtm105 -57.17 -49.13 76.93 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.68 1.592 . . . . 0.0 111.384 171.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -81.61 -29.49 33.26 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.432 1.093 . . . . 0.0 112.19 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.2 t -57.33 -49.37 76.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 122.948 0.499 . . . . 0.0 111.438 175.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.12 -47.23 75.29 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.466 1.506 . . . . 0.0 112.185 176.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.1 mt -66.6 -32.66 74.13 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -64.1 -47.12 81.25 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 122.41 0.284 . . . . 0.0 110.953 170.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.9 m -63.54 -23.5 67.42 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -60.76 -16.72 43.28 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.628 -1.295 . . . . 0.0 113.426 171.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.8 p -51.35 -33.84 31.28 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.384 0.993 . . . . 0.0 112.767 169.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.4 mt -113.01 11.15 18.93 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.757 1.223 . . . . 0.0 112.365 173.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 22.81 72.97 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.292 1.425 . . . . 0.0 113.943 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.3 mt -100.76 161.61 13.48 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.405 1.082 . . . . 0.0 113.043 -170.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.6 mt -79.54 143.4 34.86 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.716 1.606 . . . . 0.0 108.803 166.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.02 130.25 9.68 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 124.961 1.267 . . . . 0.0 112.533 178.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -138.38 156.66 47.39 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.18 1.392 . . . . 0.0 112.636 -172.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.14 137.02 32.7 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.449 1.1 . . . . 0.0 112.431 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 9.1 pt -135.31 44.53 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.699 1.199 . . . . 0.0 113.36 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 91.51 0.52 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.025 1.297 . . . . 0.0 110.827 -176.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 65.76 -6.89 0.39 Allowed 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 127.637 2.375 . . . . 0.0 117.097 175.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -133.09 142.73 48.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.076 1.35 . . . . 0.0 111.367 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.41 134.7 36.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.285 1.434 . . . . 0.0 111.386 172.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -144.21 135.17 25.24 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.78 0.832 . . . . 0.0 111.318 170.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -76.64 167.23 22.19 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.478 1.111 . . . . 0.0 113.09 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.4 m -141.55 142.66 26.85 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 112.428 -176.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.38 -4.5 15.52 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 124.393 3.395 . . . . 0.0 116.587 -169.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 32.0 m80 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 128.592 2.757 . . . . 0.0 116.825 -173.546 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 m . . . . . 0 CA--C 1.548 0.884 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -51.89 -48.62 64.01 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 123.47 1.605 . . . . 0.0 113.898 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? 62.8 -56.53 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 1 C-N-CA 133.45 4.7 . . . . 0.0 111.61 -173.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.32 -54.36 34.23 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.214 1.006 . . . . 0.0 112.277 -176.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -74.51 -30.87 61.97 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.84 172.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.5 t -58.45 -40.85 83.73 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.958 0.903 . . . . 0.0 112.886 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.62 -35.22 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.1 mt -59.44 -38.37 80.53 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.556 0.616 . . . . 0.0 112.128 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 m -79.75 -18.77 50.32 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.282 1.433 . . . . 0.0 113.793 177.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.3 m -85.42 -34.67 21.65 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.331 1.053 . . . . 0.0 112.892 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.4 mtp180 -51.91 -32.42 32.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.493 1.117 . . . . 0.0 112.659 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -61.61 -10.3 7.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.099 2.16 . . . . 0.0 116.289 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -126.34 7.0 7.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.726 1.21 . . . . 0.0 112.997 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.03 44.51 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.306 0.955 . . . . 0.0 114.325 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.7 mt -115.43 163.6 15.49 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.66 1.23 . . . . 0.0 112.799 -171.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.7 mt -108.81 155.84 20.32 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 126.091 1.756 . . . . 0.0 109.16 167.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -89.19 142.03 16.59 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 123.623 0.63 . . . . 0.0 111.652 172.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -137.53 134.13 35.33 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.087 1.355 . . . . 0.0 111.468 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -74.7 139.18 43.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.224 1.41 . . . . 0.0 111.681 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.3 pt -138.57 57.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 126.74 2.016 . . . . 0.0 111.224 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.11 91.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.731 0 C-N-CA 125.415 1.483 . . . . 0.0 112.4 177.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 64.19 2.88 1.58 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.229 1.812 . . . . 0.0 115.356 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -140.2 141.69 35.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.784 1.634 . . . . 0.0 111.917 -178.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.9 t -112.7 143.9 43.12 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.586 1.154 . . . . 0.0 112.395 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -152.2 155.71 38.31 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.207 2.203 . . . . 0.0 110.169 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.6 m -83.73 159.25 21.52 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -173.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.8 m -145.87 144.34 21.87 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 125.269 1.428 . . . . 0.0 112.376 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -82.09 -4.52 11.91 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.092 3.194 . . . . 0.0 113.356 176.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 125.548 1.539 . . . . 0.0 113.974 -174.495 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.4 m . . . . . 0 CA--C 1.546 0.801 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -66.78 -43.8 83.02 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 124.808 2.242 . . . . 0.0 113.075 173.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.4 tm? 62.34 -49.19 0.17 Allowed 'General case' 0 C--N 1.319 -0.73 1 C-N-CA 133.682 4.793 . . . . 0.0 113.532 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -73.39 -56.13 5.46 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.849 0.75 . . . . 0.0 110.842 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -60.74 -31.89 71.2 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.51 -0.744 . . . . 0.0 112.075 171.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.79 -52.32 66.2 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 168.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.404 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 89.6 mt-10 -60.16 -35.21 74.82 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.803 -1.185 . . . . 0.0 113.773 176.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.68 -46.63 78.33 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.922 0.889 . . . . 0.0 111.813 174.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -65.86 -41.57 91.48 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.043 -0.411 . . . . 0.0 111.707 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m -59.45 -29.07 67.53 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.271 -0.893 . . . . 0.0 113.307 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -61.11 -18.29 57.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 177.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -57.99 -27.65 63.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.148 1.34 . . . . 0.0 113.25 174.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -113.15 21.07 15.7 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.699 1.599 . . . . 0.0 111.731 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.44 -8.74 12.32 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.549 2.023 . . . . 0.0 116.143 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.41 161.13 31.23 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.25 1.82 . . . . 0.0 113.078 -169.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.2 mt -99.71 152.56 19.95 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.133 0.973 . . . . 0.0 109.416 165.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.404 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -99.32 141.69 15.65 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 124.84 1.21 . . . . 0.0 112.138 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 139.76 40.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.153 1.381 . . . . 0.0 110.127 172.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.4 t -75.62 128.37 35.1 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.86 0.864 . . . . 0.0 110.798 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -139.41 117.23 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.41 45.14 97.02 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 121.875 -0.516 . . . . 0.0 113.257 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 60.44 10.59 2.54 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -124.95 120.77 32.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.765 1.226 . . . . 0.0 110.606 170.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.4 t -74.85 132.28 41.39 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 174.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -126.43 153.76 44.59 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.085 1.754 . . . . 0.0 109.842 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.0 m -80.89 161.27 24.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.457 0.703 . . . . 0.0 111.324 170.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.78 138.23 32.66 Favored Pre-proline 0 N--CA 1.481 1.116 0 O-C-N 121.572 -0.705 . . . . 0.0 110.682 -178.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -72.05 -9.59 24.79 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 123.818 3.012 . . . . 0.0 115.07 -168.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.1 m80 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.486 1.914 . . . . 0.0 115.875 -175.696 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.3 m . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -66.74 -49.2 66.75 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 124.275 1.988 . . . . 0.0 112.052 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.9 tp 61.58 -51.1 0.13 Allowed 'General case' 0 C--N 1.32 -0.688 1 C-N-CA 133.157 4.583 . . . . 0.0 113.052 -171.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 71.3 mtm180 -73.84 -36.27 64.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -174.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -83.01 -36.54 24.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.039 1.736 . . . . 0.0 111.446 168.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.2 t -52.27 -45.73 65.54 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.071 0.548 . . . . 0.0 112.073 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.24 -39.38 72.46 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.155 0.982 . . . . 0.0 113.206 173.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.49 -39.17 77.81 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.014 0.926 . . . . 0.0 112.34 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -66.81 -39.21 87.63 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.436 0.694 . . . . 0.0 111.54 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.6 m -65.39 -34.63 78.76 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.961 0.904 . . . . 0.0 113.241 171.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -61.5 -25.66 67.41 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.162 0.985 . . . . 0.0 112.924 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.1 m -64.44 -10.94 28.46 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 172.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -126.63 4.6 6.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.468 1.907 . . . . 0.0 112.33 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.56 28.59 69.16 Favored Glycine 0 CA--C 1.532 1.15 0 O-C-N 121.318 -0.864 . . . . 0.0 114.24 -173.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.7 mt -109.45 167.95 9.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.427 1.491 . . . . 0.0 111.425 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 mt -112.0 142.47 44.38 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 108.914 168.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -105.43 136.32 13.11 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.606 1.098 . . . . 0.0 112.756 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -145.79 157.54 43.92 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.048 0.924 . . . . 0.0 112.533 170.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.73 123.29 28.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.7 0.8 . . . . 0.0 111.99 -177.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mm -88.6 60.2 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.447 1.499 . . . . 0.0 109.206 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.84 -54.51 2.99 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 126.242 1.877 . . . . 0.0 113.831 -170.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -153.75 11.26 0.43 Allowed 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -174.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -136.9 128.86 29.29 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.586 1.555 . . . . 0.0 107.953 168.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.8 t -81.71 150.73 27.85 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.171 -0.956 . . . . 0.0 111.772 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -150.26 135.52 17.96 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.002 0.521 . . . . 0.0 112.05 -173.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.3 m -82.11 155.41 25.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.861 0.864 . . . . 0.0 112.714 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.6 m -148.23 143.41 17.49 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 124.876 1.27 . . . . 0.0 111.365 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -77.66 -9.01 17.17 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.769 2.98 . . . . 0.0 115.333 -171.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.0 m80 . . . . . 0 C--O 1.249 1.074 0 C-N-CA 127.151 2.18 . . . . 0.0 113.999 -173.743 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.4 m . . . . . 0 C--O 1.238 0.461 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -92.56 167.2 12.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.797 1.239 . . . . 0.0 108.493 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.93 -53.04 0.47 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.37 169.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -59.59 -56.82 17.05 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.124 0.875 . . . . 0.0 112.085 169.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -66.15 -37.96 86.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.688 1.131 . . . . 0.0 112.624 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.6 t -60.57 -49.4 77.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.027 0.931 . . . . 0.0 111.878 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -63.08 -40.68 98.37 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 117.641 -1.171 . . . . 0.0 112.299 176.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.73 -45.93 88.54 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.651 1.569 . . . . 0.0 111.731 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 68.6 m -64.47 -32.39 74.0 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.1 m -82.74 -47.51 11.88 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -62.09 -20.26 63.83 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.937 1.295 . . . . 0.0 112.057 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -62.59 -23.72 67.19 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 171.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.2 mt -110.06 14.18 23.03 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.619 1.568 . . . . 0.0 111.995 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.35 20.13 76.57 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.738 1.161 . . . . 0.0 114.383 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.2 mt -92.77 162.23 14.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.522 1.529 . . . . 0.0 111.317 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -92.93 141.17 28.71 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.135 0.974 . . . . 0.0 108.781 167.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.3 132.34 11.08 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 124.808 1.194 . . . . 0.0 111.922 177.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.7 154.89 34.96 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.208 1.003 . . . . 0.0 112.849 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.5 t -91.18 132.17 36.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.536 1.134 . . . . 0.0 112.082 -174.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -75.13 -37.25 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.759 0.823 . . . . 0.0 110.604 170.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 165.48 -38.07 0.27 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 126.113 1.816 . . . . 0.0 111.839 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -148.82 7.53 0.74 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.064 2.145 . . . . 0.0 113.278 169.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.62 132.65 52.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.409 1.883 . . . . 0.0 111.325 173.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.06 141.42 45.73 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.437 1.095 . . . . 0.0 111.97 172.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -131.03 141.35 50.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.095 2.158 . . . . 0.0 111.105 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.1 m -103.87 153.7 20.46 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.077 0.951 . . . . 0.0 112.003 169.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.9 m -148.4 144.5 18.7 Favored Pre-proline 0 N--CA 1.484 1.229 0 C-N-CA 124.428 1.091 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -87.88 -14.57 3.5 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.722 2.948 . . . . 0.0 114.187 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--O 1.252 1.212 0 C-N-CA 126.562 1.945 . . . . 0.0 116.192 -168.562 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -93.83 178.93 5.51 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 162.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.78 -66.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.5 tpp85 -59.46 -49.05 79.3 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.067 0.849 . . . . 0.0 112.287 177.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -62.13 -35.21 78.06 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.057 0.943 . . . . 0.0 112.299 177.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -71.09 -50.54 32.61 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.221 1.408 . . . . 0.0 111.321 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.79 -37.19 75.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.864 1.666 . . . . 0.0 112.54 176.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.09 -40.34 82.68 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.775 1.23 . . . . 0.0 112.811 174.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.8 t -58.42 -46.77 85.82 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 169.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 78.2 m -68.97 -31.43 70.29 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -56.61 -33.73 66.54 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.801 1.24 . . . . 0.0 111.731 174.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.5 m -68.9 -3.15 11.59 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.8 mt -125.18 7.01 7.84 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 120.127 1.331 . . . . 0.0 111.769 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.9 27.76 71.73 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.799 1.19 . . . . 0.0 113.956 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.2 mt -110.15 161.61 15.4 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.049 1.74 . . . . 0.0 112.076 -178.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -96.96 148.91 22.49 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.579 1.151 . . . . 0.0 108.9 166.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -96.48 140.95 15.34 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.189 1.376 . . . . 0.0 112.126 174.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -136.12 134.56 38.46 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.961 1.704 . . . . 0.0 111.06 -178.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.5 t -76.89 137.88 39.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.188 0.595 . . . . 0.0 112.306 173.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -121.72 75.74 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.493 1.517 . . . . 0.0 108.853 172.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.35 -55.11 2.81 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.306 1.908 . . . . 0.0 114.526 175.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -146.91 -0.83 0.7 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.932 1.293 . . . . 0.0 114.326 -174.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -142.86 134.33 26.33 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.302 1.041 . . . . 0.0 110.776 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.8 t -97.13 138.77 34.13 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.007 0.923 . . . . 0.0 112.29 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -137.66 162.85 32.74 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.388 1.875 . . . . 0.0 112.066 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.5 m -80.32 161.83 24.86 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.64 143.43 32.41 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 123.404 0.682 . . . . 0.0 112.064 -176.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.63 -1.79 11.79 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.883 3.056 . . . . 0.0 114.529 -172.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.9 m80 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 125.158 1.383 . . . . 0.0 113.696 -169.525 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t . . . . . 0 CA--C 1.55 0.971 0 CA-C-O 120.984 0.421 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -72.68 163.71 27.65 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.873 -1.142 . . . . 0.0 110.445 169.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -134.29 -71.33 0.5 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.254 1.021 . . . . 0.0 109.432 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 -55.17 -38.63 68.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.835 1.254 . . . . 0.0 112.919 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -86.75 -30.12 21.84 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.26 1.424 . . . . 0.0 113.817 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.6 t -62.78 -37.32 86.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.79 0.436 . . . . 0.0 111.424 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -52.1 -32.13 33.72 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.1 mt -78.25 -26.99 47.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.712 1.205 . . . . 0.0 112.337 -178.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.1 m -74.86 -41.94 58.87 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.546 0.738 . . . . 0.0 110.581 168.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.415 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.3 m -68.51 -23.46 64.55 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.399 1.079 . . . . 0.0 113.195 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -52.5 -26.11 12.1 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.311 1.844 . . . . 0.0 113.536 174.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 t -53.86 -34.33 59.01 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.3 mt -119.91 21.98 11.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.722 1.609 . . . . 0.0 112.157 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.09 23.95 71.56 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 123.972 0.796 . . . . 0.0 114.557 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 18.0 mt -94.01 163.93 13.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.131 1.372 . . . . 0.0 110.702 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -105.69 159.98 15.57 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.389 1.076 . . . . 0.0 108.398 166.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.57 138.47 13.94 Favored Glycine 0 CA--C 1.528 0.858 0 CA-C-O 118.622 -1.099 . . . . 0.0 111.671 177.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -137.29 135.58 37.25 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.827 2.051 . . . . 0.0 109.302 175.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.59 136.02 34.92 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.153 -0.967 . . . . 0.0 111.287 173.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.6 mt -120.72 100.46 9.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 124.883 1.273 . . . . 0.0 108.58 175.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 -66.98 2.4 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 127.222 2.344 . . . . 0.0 112.112 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -159.2 16.97 0.17 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.331 1.452 . . . . 0.0 112.974 -170.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -149.28 133.54 17.38 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.918 1.287 . . . . 0.0 110.315 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -84.04 133.28 34.67 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -118.35 156.67 28.53 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 127.994 2.518 . . . . 0.0 109.787 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -95.29 156.67 16.22 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.478 0.711 . . . . 0.0 112.442 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.2 m -142.0 140.89 20.33 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -85.97 70.55 4.58 Favored 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.755 4.304 . . . . 0.0 110.939 176.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.6 p80 . . . . . 0 C--O 1.25 1.111 0 C-N-CA 129.51 3.124 . . . . 0.0 117.491 -173.822 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.534 0.352 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -76.6 172.75 12.51 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.457 -0.777 . . . . 0.0 109.387 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.17 -59.51 1.04 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.423 168.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -62.29 -51.71 66.59 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.877 1.217 . . . . 0.0 112.07 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -65.0 -28.98 69.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.4 0.68 . . . . 0.0 112.068 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.3 t -68.06 -49.36 61.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 117.878 0.308 . . . . 0.0 111.114 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.85 -37.88 83.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.124 1.369 . . . . 0.0 112.545 174.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.07 -39.78 94.82 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.962 0.905 . . . . 0.0 112.471 172.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.9 m -68.95 -46.53 67.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.09 0.556 . . . . 0.0 111.583 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.5 m -62.72 -19.2 63.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.729 1.212 . . . . 0.0 114.051 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -55.56 -21.81 18.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.385 1.074 . . . . 0.0 112.522 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -56.12 -22.34 27.73 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.724 1.21 . . . . 0.0 114.003 173.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.9 mt -120.4 10.73 11.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.537 1.535 . . . . 0.0 112.881 170.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.88 24.87 76.65 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 124.674 1.131 . . . . 0.0 113.839 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.7 mt -97.84 168.59 10.22 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.985 1.314 . . . . 0.0 111.55 -177.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -106.24 171.95 7.07 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 164.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.72 138.45 9.95 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 123.902 0.763 . . . . 0.0 113.213 -168.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -142.16 144.9 33.66 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.744 1.617 . . . . 0.0 111.661 -173.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.64 157.05 34.23 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.651 1.58 . . . . 0.0 114.222 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 15.5 mt -140.35 78.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 128.168 2.587 . . . . 0.0 107.243 168.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -56.08 0.42 Allowed Glycine 0 CA--C 1.536 1.397 0 C-N-CA 128.442 2.925 . . . . 0.0 115.086 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -145.3 -8.28 0.6 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.716 2.006 . . . . 0.0 114.638 -176.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -111.76 129.34 56.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.331 1.452 . . . . 0.0 109.897 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.9 t -99.42 127.37 45.45 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.507 1.049 . . . . 0.0 111.922 174.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -131.2 145.08 51.79 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.078 1.751 . . . . 0.0 112.23 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.6 m -84.33 159.79 20.83 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.53 142.86 24.41 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.223 1.009 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -77.89 -4.1 14.14 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 124.667 3.578 . . . . 0.0 113.193 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.9 m80 . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.236 1.815 . . . . 0.0 114.097 -175.664 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.3 t . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -87.91 155.01 20.07 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.25 -0.907 . . . . 0.0 111.958 -174.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.61 -64.71 0.74 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.782 0.833 . . . . 0.0 109.439 174.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -59.78 -36.06 75.91 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -81.29 -35.1 31.48 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 119.306 0.957 . . . . 0.0 113.202 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.9 t -64.25 -42.83 96.33 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -56.21 -32.67 64.62 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 120.819 -1.175 . . . . 0.0 112.264 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 69.5 mt -73.69 -29.24 62.17 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.872 1.269 . . . . 0.0 113.435 175.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.2 t -69.92 -47.84 60.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.29 0.636 . . . . 0.0 110.578 169.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.6 m -59.62 -35.38 74.23 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.63 -0.669 . . . . 0.0 112.668 177.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -56.12 -23.18 32.7 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.149 1.38 . . . . 0.0 113.546 174.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.4 t -59.79 -28.25 67.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.302 1.041 . . . . 0.0 113.581 172.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -113.44 18.75 17.48 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.035 1.734 . . . . 0.0 111.089 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.67 5.52 24.54 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 126.995 2.236 . . . . 0.0 115.349 -173.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.8 mt -75.31 165.63 24.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.178 1.791 . . . . 0.0 113.042 -173.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 tp -98.57 160.43 14.28 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.814 2.046 . . . . 0.0 108.806 168.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -130.64 145.05 16.46 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-N 120.272 1.396 . . . . 0.0 114.658 -178.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.46 147.36 32.11 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 126.422 1.889 . . . . 0.0 112.063 175.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 t -81.85 120.01 24.65 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.278 0.49 . . . . 0.0 112.065 176.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -89.07 -63.64 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.579 -0.701 . . . . 0.0 111.449 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -151.52 73.83 0.27 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 125.236 1.398 . . . . 0.0 110.446 -178.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 61.18 22.06 12.42 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.954 1.701 . . . . 0.0 113.735 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.87 129.22 13.8 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 125.891 1.676 . . . . 0.0 110.381 169.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.2 t -76.01 129.2 36.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.795 1.238 . . . . 0.0 112.342 175.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -106.09 137.68 43.59 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.648 1.979 . . . . 0.0 109.489 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.0 m -87.34 147.23 25.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.974 0.416 . . . . 0.0 112.038 169.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.3 m -141.64 142.22 25.15 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 124.281 1.032 . . . . 0.0 112.775 -168.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.56 9.39 4.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.644 3.563 . . . . 0.0 114.504 -171.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.5 m80 . . . . . 0 C--O 1.25 1.085 0 C-N-CA 126.157 1.783 . . . . 0.0 114.23 179.305 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.548 0.888 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -94.06 159.31 15.22 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.241 -0.912 . . . . 0.0 110.85 169.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -127.82 -66.13 0.88 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.873 1.269 . . . . 0.0 108.624 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -62.73 -37.64 87.35 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.697 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -80.74 -33.01 35.43 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.987 0.812 . . . . 0.0 112.353 171.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.1 t -61.45 -42.32 98.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.825 0.739 . . . . 0.0 112.328 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -57.57 -22.29 43.94 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.755 -1.216 . . . . 0.0 113.813 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.1 mt -63.84 -24.97 67.96 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.539 1.063 . . . . 0.0 113.545 175.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -82.5 -44.66 15.68 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.949 -0.469 . . . . 0.0 111.175 169.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 79.6 m -67.6 -43.93 79.33 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.9 -18.25 65.21 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.115 0.966 . . . . 0.0 113.169 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.3 t -65.28 -24.12 67.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.463 0.705 . . . . 0.0 112.564 171.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -107.81 12.9 26.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.914 1.686 . . . . 0.0 111.904 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.57 22.56 77.91 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 125.294 1.426 . . . . 0.0 114.761 -176.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 mt -96.61 171.56 8.46 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.228 1.411 . . . . 0.0 112.701 -174.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.8 tp -108.3 147.28 31.68 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.198 2.599 . . . . 0.0 108.685 168.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.89 130.2 10.15 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.445 1.022 . . . . 0.0 113.057 173.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -140.0 149.44 43.23 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.28 1.832 . . . . 0.0 111.751 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.5 m -78.95 116.53 19.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.735 0.814 . . . . 0.0 111.875 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 7.8 tt -83.53 -11.25 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 125.732 1.613 . . . . 0.0 114.646 -172.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 175.3 -48.89 0.13 Allowed Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.944 1.735 . . . . 0.0 111.579 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -154.99 14.57 0.4 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.655 1.982 . . . . 0.0 112.566 168.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -142.05 146.9 36.0 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.237 1.815 . . . . 0.0 111.386 -175.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.9 t -86.37 127.0 34.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.69 0.677 . . . . 0.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -132.37 150.19 52.21 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.855 0.862 . . . . 0.0 112.777 172.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -87.77 149.11 24.39 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -169.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 m -146.28 144.07 20.51 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.127 1.371 . . . . 0.0 112.777 -174.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -88.76 0.69 6.35 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.304 3.336 . . . . 0.0 115.914 -170.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.1 m80 . . . . . 0 C--O 1.256 1.404 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -171.706 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.2 t . . . . . 0 CA--C 1.558 1.283 0 N-CA-C 115.273 1.582 . . . . 0.0 115.273 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.07 171.27 14.41 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.472 -1.392 . . . . 0.0 112.578 174.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -139.69 -59.52 0.56 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.312 1.045 . . . . 0.0 109.929 169.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.53 -23.36 66.86 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -93.64 -36.24 12.46 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.353 1.061 . . . . 0.0 112.514 169.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -67.49 -37.38 82.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.658 0.783 . . . . 0.0 113.084 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.87 -31.89 65.28 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.996 -1.065 . . . . 0.0 112.235 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 mt -64.79 -42.13 95.28 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.359 1.064 . . . . 0.0 112.895 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.8 p -78.09 -35.41 49.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.988 1.315 . . . . 0.0 112.416 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.1 m -70.48 -44.8 66.96 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 172.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -65.13 -21.89 66.85 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.595 -1.315 . . . . 0.0 112.894 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.6 m -61.46 -19.04 61.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 169.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.7 mt -112.18 13.62 20.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.406 1.882 . . . . 0.0 112.492 175.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 24.76 67.62 Favored Glycine 0 CA--C 1.54 1.621 0 C-N-CA 124.151 0.881 . . . . 0.0 115.266 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.1 mt -111.13 -179.15 3.65 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.457 2.303 . . . . 0.0 111.748 -174.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.8 mt -107.42 163.42 13.06 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.539 1.535 . . . . 0.0 107.96 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.92 132.03 9.63 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.53 1.538 . . . . 0.0 111.824 174.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -145.04 139.68 27.59 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.739 1.615 . . . . 0.0 111.285 -175.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.8 t -76.75 138.36 39.88 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.393 -0.817 . . . . 0.0 112.297 175.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.9 mm -82.39 -57.34 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.329 1.452 . . . . 0.0 110.728 170.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.04 -41.02 0.04 OUTLIER Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.158 0.885 . . . . 0.0 113.797 178.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -132.06 0.97 3.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.498 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -140.08 154.13 46.96 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.396 2.278 . . . . 0.0 110.296 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.1 t -110.87 137.31 48.67 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.54 0.736 . . . . 0.0 111.823 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -141.15 163.51 32.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.971 1.708 . . . . 0.0 110.627 -170.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.9 m -101.11 158.34 16.09 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -168.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -149.52 147.3 22.69 Favored Pre-proline 0 N--CA 1.483 1.189 0 C-N-CA 124.1 0.96 . . . . 0.0 113.466 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -84.22 63.24 6.84 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 125.297 3.998 . . . . 0.0 112.265 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.0 m80 . . . . . 0 C--O 1.252 1.224 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 172.802 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.5 m . . . . . 0 CA--C 1.546 0.8 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -78.36 174.57 11.12 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.431 -0.793 . . . . 0.0 110.938 167.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.8 tt -142.62 -63.76 0.42 Allowed 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.698 -0.626 . . . . 0.0 110.252 168.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -39.15 81.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.055 0.942 . . . . 0.0 112.025 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -78.71 -33.08 47.1 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.99 1.268 . . . . 0.0 112.837 172.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.1 t -67.49 -40.82 85.26 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.863 0.865 . . . . 0.0 112.441 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -60.23 -42.11 94.55 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.783 -1.198 . . . . 0.0 112.275 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.6 mt -66.89 -41.49 87.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.243 1.017 . . . . 0.0 112.074 174.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.8 t -63.25 -45.31 92.14 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.466 1.107 . . . . 0.0 112.199 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -70.2 -31.53 69.03 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -63.67 -24.04 67.62 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.936 -1.103 . . . . 0.0 112.414 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -66.55 1.57 1.66 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 170.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -128.16 4.14 5.82 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.657 1.983 . . . . 0.0 111.48 167.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.11 31.41 38.83 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 126.382 1.944 . . . . 0.0 114.402 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -121.68 159.79 25.83 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.907 1.353 . . . . 0.0 112.6 -170.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.4 tp -87.39 148.64 24.92 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.016 1.727 . . . . 0.0 109.341 168.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -108.36 128.59 9.17 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.584 1.088 . . . . 0.0 113.411 175.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -141.99 143.15 33.06 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 127.563 2.345 . . . . 0.0 112.147 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.6 t -72.55 146.85 46.46 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.374 1.069 . . . . 0.0 113.137 174.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.3 pt -123.16 10.36 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 125.436 1.494 . . . . 0.0 114.37 171.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.15 -58.42 0.51 Allowed Glycine 0 CA--C 1.53 0.984 0 C-N-CA 125.373 1.463 . . . . 0.0 112.157 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -142.09 -0.11 1.32 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.85 1.26 . . . . 0.0 113.298 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -125.33 135.35 52.37 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.891 1.677 . . . . 0.0 109.774 170.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.7 t -90.29 117.29 28.92 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.956 -0.465 . . . . 0.0 110.05 168.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -102.59 165.85 10.85 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.869 1.268 . . . . 0.0 112.02 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -102.54 148.44 25.53 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.5 m -150.75 152.94 33.05 Favored Pre-proline 0 N--CA 1.478 0.966 0 C-N-CA 124.971 1.308 . . . . 0.0 112.417 -173.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -77.19 68.42 7.41 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.704 3.602 . . . . 0.0 110.424 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.9 m80 . . . . . 0 C--O 1.248 1.014 0 C-N-CA 128.626 2.77 . . . . 0.0 114.072 169.793 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.5 t . . . . . 0 CA--C 1.537 0.461 0 CA-C-O 118.852 -0.594 . . . . 0.0 111.646 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.48 165.77 16.02 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.51 1.05 . . . . 0.0 111.958 173.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -133.55 -62.64 0.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 108.363 169.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 79.1 mtp85 -61.59 -38.08 86.25 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -88.86 -20.91 24.01 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 169.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.3 t -63.83 -42.17 97.68 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.159 0.891 . . . . 0.0 111.389 173.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -50.03 -42.01 48.6 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.479 1.112 . . . . 0.0 112.769 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.67 -30.39 70.7 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.672 1.189 . . . . 0.0 112.59 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -73.17 -48.47 35.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.937 0.895 . . . . 0.0 111.742 171.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.9 m -60.68 -31.5 70.75 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -62.43 -17.78 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.746 1.218 . . . . 0.0 114.162 175.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.3 p -57.53 -24.7 57.52 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.82 1.191 . . . . 0.0 114.03 170.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 77.7 mt -124.09 16.5 9.21 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.52 1.928 . . . . 0.0 112.044 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.49 25.6 70.21 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.362 0.982 . . . . 0.0 114.801 -177.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.4 mt -86.65 169.23 12.89 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.308 1.443 . . . . 0.0 111.763 -178.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -98.88 140.77 32.55 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.924 2.49 . . . . 0.0 108.412 168.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.08 136.57 12.76 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.424 1.011 . . . . 0.0 113.654 177.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -141.78 138.99 32.67 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.925 1.69 . . . . 0.0 112.277 177.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -77.36 133.86 38.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.709 0.804 . . . . 0.0 112.521 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.4 mm -86.35 -37.73 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.827 0.851 . . . . 0.0 112.011 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 170.55 -53.13 0.19 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.716 1.151 . . . . 0.0 112.829 175.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -123.24 -3.31 8.48 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.416 1.886 . . . . 0.0 112.921 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -150.04 144.63 25.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.322 1.849 . . . . 0.0 111.099 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.9 t -91.34 145.95 24.22 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.014 0.925 . . . . 0.0 113.439 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.5 tptt -128.78 132.36 47.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.304 2.642 . . . . 0.0 109.596 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -83.1 157.61 22.76 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.676 0.79 . . . . 0.0 113.094 176.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.1 m -149.9 147.59 22.9 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 125.839 1.655 . . . . 0.0 111.034 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -90.16 25.62 0.55 Allowed 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.765 2.976 . . . . 0.0 115.205 -169.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 . . . . . 0 C--O 1.253 1.253 0 CA-C-O 116.999 -1.477 . . . . 0.0 113.846 -179.009 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.865 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -129.28 164.38 23.62 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.064 1.746 . . . . 0.0 110.662 169.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.6 tp -136.06 -61.34 0.71 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.152 0.981 . . . . 0.0 111.187 173.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.6 ttm-85 -61.18 -42.04 97.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.759 0.824 . . . . 0.0 112.26 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 tpp180 -68.42 -44.71 74.41 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.618 1.567 . . . . 0.0 111.866 168.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -55.36 -40.26 71.06 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.815 0.846 . . . . 0.0 112.377 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -61.26 -36.82 81.06 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.694 -1.254 . . . . 0.0 114.06 173.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 71.3 mt -71.03 -36.12 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.606 0.762 . . . . 0.0 111.846 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.3 m -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.465 1.106 . . . . 0.0 113.124 173.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.8 m -82.44 -12.53 57.8 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.0 mtm180 -53.73 -23.56 12.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.803 0.841 . . . . 0.0 112.655 167.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 99.0 p -41.85 -37.06 1.18 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.851 2.06 . . . . 0.0 114.915 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -133.35 19.07 3.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.708 2.003 . . . . 0.0 111.491 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.21 16.87 77.1 Favored Glycine 0 CA--C 1.537 1.435 0 C-N-CA 125.204 1.383 . . . . 0.0 115.178 -178.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.5 mt -94.43 166.93 11.82 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.653 1.581 . . . . 0.0 112.939 -170.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 mt -90.02 160.75 16.19 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.793 -1.094 . . . . 0.0 108.96 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -114.57 144.13 18.26 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.391 0.995 . . . . 0.0 112.701 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -140.99 151.76 44.38 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.226 1.81 . . . . 0.0 110.892 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 t -91.24 113.82 26.18 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 168.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.0 mt -129.7 104.77 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -174.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.49 54.85 17.43 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.124 0.868 . . . . 0.0 113.122 -175.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 60.37 18.42 8.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.962 1.705 . . . . 0.0 114.92 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -144.37 143.42 30.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.879 1.672 . . . . 0.0 112.409 176.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.9 t -70.67 137.7 50.04 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.807 1.243 . . . . 0.0 110.989 178.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -157.03 161.2 39.53 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.94 1.296 . . . . 0.0 111.764 168.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.5 m -94.33 159.92 14.91 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -169.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -147.79 148.92 31.89 Favored Pre-proline 0 N--CA 1.478 0.928 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -168.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -82.67 60.08 7.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.255 3.97 . . . . 0.0 112.648 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.1 m80 . . . . . 0 C--O 1.248 1.018 0 C-N-CA 127.735 2.414 . . . . 0.0 115.181 171.634 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -135.51 160.8 37.34 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.386 1.474 . . . . 0.0 110.095 168.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.6 tp -131.06 -67.87 0.69 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.91 0.884 . . . . 0.0 109.497 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -43.42 87.66 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.173 -0.918 . . . . 0.0 113.263 177.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -70.8 -40.61 72.42 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 118.863 0.756 . . . . 0.0 112.364 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.99 -44.35 87.12 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 117.695 0.225 . . . . 0.0 110.964 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -57.75 -33.61 68.66 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.982 1.313 . . . . 0.0 114.388 176.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 93.8 mt -70.92 -45.27 64.52 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.163 0.892 . . . . 0.0 111.497 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -62.17 -37.09 83.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.821 0.448 . . . . 0.0 111.632 171.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.4 m -67.26 -32.38 73.36 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 172.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -61.67 -25.87 67.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.817 -1.177 . . . . 0.0 112.42 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 m -61.85 -15.62 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 174.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -120.18 8.22 10.89 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 112.038 173.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.16 36.82 90.76 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.997 1.284 . . . . 0.0 113.755 -173.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 mt -109.24 159.93 16.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.663 1.185 . . . . 0.0 112.231 -177.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -89.77 150.12 22.42 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.864 2.065 . . . . 0.0 108.314 167.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.12 130.37 8.36 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 119.233 0.924 . . . . 0.0 111.763 174.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -134.67 147.2 50.08 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.786 1.634 . . . . 0.0 111.893 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.8 t -85.89 132.74 34.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 122.983 0.513 . . . . 0.0 111.2 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.3 pt -134.2 1.71 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -168.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.18 45.01 0.02 OUTLIER Glycine 0 N--CA 1.473 1.146 0 CA-C-N 119.484 1.038 . . . . 0.0 114.404 -173.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 62.02 25.11 15.03 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.008 1.323 . . . . 0.0 112.298 -169.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -158.32 147.56 19.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 128.202 2.601 . . . . 0.0 109.483 178.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -101.56 142.49 32.85 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 124.533 1.133 . . . . 0.0 111.813 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -127.85 134.17 49.4 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.821 1.248 . . . . 0.0 110.266 172.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.37 156.6 39.1 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 174.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.2 m -151.57 146.47 18.88 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 125.102 1.361 . . . . 0.0 111.646 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -81.08 62.68 8.6 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.867 3.045 . . . . 0.0 111.411 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.0 m80 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 127.94 2.496 . . . . 0.0 114.213 179.67 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.535 0.381 0 CA-C-O 119.807 -0.14 . . . . 0.0 111.316 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -92.35 166.51 12.54 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.737 -0.602 . . . . 0.0 109.938 167.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -130.38 -68.46 0.69 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 118.498 -0.763 . . . . 0.0 109.932 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -63.83 -47.3 81.33 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.934 1.243 . . . . 0.0 112.296 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -63.54 -38.2 90.21 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.563 0.62 . . . . 0.0 111.229 174.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.5 t -59.06 -46.01 89.33 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 172.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.61 -38.64 78.44 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.679 -1.263 . . . . 0.0 112.343 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.4 mt -71.72 -29.91 65.06 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -71.32 -39.53 71.33 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.901 0.881 . . . . 0.0 111.621 172.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 72.9 m -69.98 -27.98 65.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.709 1.204 . . . . 0.0 112.606 173.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 48.8 ttp85 -54.31 -32.48 56.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.925 1.29 . . . . 0.0 112.191 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.6 m -64.28 -7.19 8.58 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.0 mt -127.64 19.77 6.69 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.507 1.503 . . . . 0.0 111.723 169.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.88 20.7 70.8 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.203 0.906 . . . . 0.0 114.169 -175.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 31.4 mt -99.55 158.62 15.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.92 1.688 . . . . 0.0 111.662 -176.231 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -97.66 155.72 16.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.232 2.213 . . . . 0.0 109.157 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.53 125.61 6.77 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 124.231 0.92 . . . . 0.0 113.379 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -119.46 117.79 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.834 1.654 . . . . 0.0 111.129 179.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.0 t -73.25 122.03 21.3 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.804 -0.56 . . . . 0.0 110.428 172.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -87.33 -35.48 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 0.0 112.407 -174.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.79 -32.91 0.13 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.593 1.092 . . . . 0.0 114.925 173.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -138.32 -19.53 1.1 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.329 2.252 . . . . 0.0 111.908 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -134.64 148.49 50.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.226 1.811 . . . . 0.0 111.423 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -101.03 143.31 31.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.787 1.235 . . . . 0.0 112.93 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -119.87 141.77 49.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 127.223 2.209 . . . . 0.0 110.583 -175.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -91.14 152.31 20.63 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 171.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 m -153.65 153.89 29.57 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.501 1.52 . . . . 0.0 111.202 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.58 -17.8 26.17 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 121.832 1.688 . . . . 0.0 112.089 169.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 . . . . . 0 C--O 1.248 0.98 0 C-N-CA 127.064 2.146 . . . . 0.0 114.912 -174.837 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.1 t . . . . . 0 CA--C 1.543 0.688 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -93.33 159.64 15.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.256 1.022 . . . . 0.0 109.811 168.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -137.49 -65.24 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.341 0.656 . . . . 0.0 110.428 172.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.78 -23.78 66.42 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 177.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -89.1 -41.21 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.054 1.742 . . . . 0.0 111.99 169.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.3 t -58.93 -42.19 89.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.233 1.013 . . . . 0.0 112.159 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -56.95 -32.43 66.0 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.993 1.317 . . . . 0.0 114.111 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.0 mt -71.72 -40.27 69.57 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.632 -0.667 . . . . 0.0 111.732 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.5 t -73.83 -30.81 62.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.0 m -63.27 -36.68 84.48 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.088 -1.007 . . . . 0.0 113.13 172.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -59.07 -30.96 68.45 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.228 -0.92 . . . . 0.0 112.982 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -66.74 -14.3 62.4 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -114.79 6.62 15.58 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.53 1.532 . . . . 0.0 112.146 170.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.04 36.55 40.65 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.285 1.422 . . . . 0.0 114.609 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -123.34 160.78 26.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.595 1.558 . . . . 0.0 112.104 -169.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.6 mt -86.03 152.9 22.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.847 0.859 . . . . 0.0 108.728 165.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.56 128.94 9.71 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.855 0.741 . . . . 0.0 111.36 170.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -142.37 134.18 27.01 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.536 1.534 . . . . 0.0 111.653 -176.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 12.2 t -75.06 151.75 38.66 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -176.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.5 mt -97.98 -44.56 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.481 1.912 . . . . 0.0 109.689 169.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 168.69 -56.65 0.21 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.095 1.807 . . . . 0.0 110.905 177.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -126.71 11.12 7.22 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.371 1.468 . . . . 0.0 113.313 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -137.47 150.13 47.35 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 128.06 2.544 . . . . 0.0 109.887 168.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 39.2 t -105.38 147.28 28.38 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.778 0.831 . . . . 0.0 111.061 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -128.91 140.36 51.71 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.062 1.745 . . . . 0.0 111.038 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.2 m -88.86 146.79 24.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.246 0.618 . . . . 0.0 112.205 169.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.9 m -141.42 143.51 30.35 Favored Pre-proline 0 N--CA 1.482 1.127 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -84.29 57.3 5.21 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.582 3.521 . . . . 0.0 112.636 179.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 . . . . . 0 C--O 1.254 1.334 0 C-N-CA 127.833 2.453 . . . . 0.0 115.204 171.27 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.0 t . . . . . 0 CA--C 1.551 0.997 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -68.51 159.28 32.1 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.442 -0.786 . . . . 0.0 109.332 168.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -127.06 -76.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.202 1.401 . . . . 0.0 109.128 171.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -64.71 -33.3 75.63 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 117.916 -1.04 . . . . 0.0 112.573 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -77.13 -33.52 56.77 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.151 0.981 . . . . 0.0 112.707 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.3 t -61.87 -42.89 99.6 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.844 0.747 . . . . 0.0 111.675 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -54.76 -32.06 59.46 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.229 1.012 . . . . 0.0 113.485 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.4 mt -69.71 -30.55 68.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.046 0.939 . . . . 0.0 112.88 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 72.2 m -75.11 -41.68 58.07 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.623 0.769 . . . . 0.0 110.866 169.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.418 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.8 m -65.5 -23.43 66.89 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.514 1.125 . . . . 0.0 113.682 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -51.21 -28.13 10.65 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.647 1.979 . . . . 0.0 113.087 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.9 t -51.33 -34.71 34.81 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.663 1.585 . . . . 0.0 113.586 175.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.1 mt -122.18 19.59 10.69 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.105 1.362 . . . . 0.0 112.646 -177.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.2 24.67 74.74 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.246 0.926 . . . . 0.0 114.088 -178.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.418 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 16.5 mt -102.02 159.58 15.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.449 1.5 . . . . 0.0 112.101 -175.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.7 mt -93.5 173.4 7.72 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 164.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -132.29 139.0 10.57 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -139.54 137.38 35.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.397 1.079 . . . . 0.0 110.215 -174.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.0 t -84.17 142.55 30.25 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 176.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.0 mt -142.72 117.52 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.782 1.633 . . . . 0.0 107.78 173.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.77 44.97 96.52 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.683 -0.635 . . . . 0.0 114.061 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 68.49 28.91 5.84 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -148.89 146.75 28.05 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.092 -1.63 . . . . 0.0 111.583 168.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -89.03 153.19 21.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 174.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -147.42 144.49 28.69 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.427 1.891 . . . . 0.0 110.362 172.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.6 m -83.85 153.43 24.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.75 143.35 14.01 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.45 1.5 . . . . 0.0 111.911 -177.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.76 -21.22 6.11 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.549 2.833 . . . . 0.0 114.52 -169.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 126.439 1.896 . . . . 0.0 114.026 -169.758 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.3 t . . . . . 0 CA--C 1.551 1.015 0 CA-C-O 121.732 0.777 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -73.31 157.15 37.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.122 -0.986 . . . . 0.0 109.274 169.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -127.14 -72.09 0.65 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 117.879 -1.058 . . . . 0.0 110.988 171.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -62.01 -42.0 98.68 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 121.012 1.733 . . . . 0.0 112.922 173.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.3 mtt-85 -66.01 -35.95 81.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 118.757 0.708 . . . . 0.0 111.034 175.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.85 -42.42 97.57 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.103 0.961 . . . . 0.0 112.157 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 88.2 mt-10 -59.48 -29.83 68.11 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.927 -1.108 . . . . 0.0 112.909 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -72.52 -42.12 65.12 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.044 0.838 . . . . 0.0 112.595 170.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 m -62.28 -39.54 93.26 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.429 0.692 . . . . 0.0 111.637 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.0 m -70.73 -30.32 66.82 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.462 1.505 . . . . 0.0 113.405 175.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -57.0 -27.03 61.23 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.916 -1.115 . . . . 0.0 112.398 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.67 -17.84 50.07 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 175.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 98.8 mt -117.93 9.08 12.73 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.608 1.095 . . . . 0.0 112.914 170.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.13 18.39 74.62 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.73 1.157 . . . . 0.0 114.093 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 34.9 mt -95.06 176.51 6.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.06 1.744 . . . . 0.0 111.307 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.03 168.76 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.691 1.996 . . . . 0.0 108.076 165.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.424 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -116.62 149.22 18.81 Favored Glycine 0 N--CA 1.471 1.016 0 C-N-CA 124.165 0.888 . . . . 0.0 114.178 -172.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -138.38 133.95 33.54 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.297 1.839 . . . . 0.0 109.464 170.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.4 t -75.25 142.46 43.35 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.307 -0.871 . . . . 0.0 111.228 172.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.4 mm -93.86 -30.27 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.629 1.172 . . . . 0.0 111.689 175.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 162.08 -39.7 0.38 Allowed Glycine 0 N--CA 1.472 1.084 0 C-N-CA 125.709 1.624 . . . . 0.0 114.112 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -124.61 -10.21 7.35 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.398 1.479 . . . . 0.0 112.338 174.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -148.92 154.25 39.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.524 1.93 . . . . 0.0 110.9 -176.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -96.87 152.32 18.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.027 0.931 . . . . 0.0 113.056 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -130.59 143.78 50.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.537 1.535 . . . . 0.0 110.349 169.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -84.07 158.82 21.3 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 m -144.81 139.96 15.86 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 126.517 1.927 . . . . 0.0 110.739 -175.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -92.76 -24.22 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.741 2.961 . . . . 0.0 116.656 -168.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 C--O 1.253 1.282 0 C-N-CA 126.995 2.118 . . . . 0.0 113.201 -168.834 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.552 1.021 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -126.98 174.33 8.94 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.056 1.343 . . . . 0.0 111.038 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.73 -73.57 0.43 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.31 1.044 . . . . 0.0 110.391 168.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.3 tpp85 -57.62 -45.74 85.01 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.365 1.438 . . . . 0.0 112.051 175.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.78 -28.42 67.59 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.382 -0.823 . . . . 0.0 113.037 176.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.4 t -67.95 -43.94 77.91 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.616 0.766 . . . . 0.0 111.586 169.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.37 -39.78 88.45 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.65 -1.281 . . . . 0.0 113.339 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -40.98 91.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.18 0.592 . . . . 0.0 111.69 175.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.9 t -63.43 -39.14 93.69 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 173.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 90.3 m -69.0 -12.21 61.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.035 1.334 . . . . 0.0 114.597 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -54.32 -26.48 29.8 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 121.162 -0.961 . . . . 0.0 112.532 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.5 t -54.97 -38.32 67.64 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -116.72 20.01 14.21 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.364 1.465 . . . . 0.0 113.579 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.52 25.82 73.77 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 120.92 -1.113 . . . . 0.0 115.029 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.8 mt -90.18 170.85 9.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.504 1.521 . . . . 0.0 111.353 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 mt -113.11 152.63 29.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.255 1.422 . . . . 0.0 110.037 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.41 131.07 9.93 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.235 0.921 . . . . 0.0 113.682 -172.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -131.25 141.04 49.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.022 1.329 . . . . 0.0 111.86 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.57 125.82 32.18 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.346 1.058 . . . . 0.0 111.911 -177.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -75.44 -47.25 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.626 1.17 . . . . 0.0 111.19 -177.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.44 -34.54 0.12 Allowed Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.613 1.578 . . . . 0.0 113.461 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -120.86 -26.02 5.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.629 1.972 . . . . 0.0 112.549 171.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -140.2 152.36 45.93 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.294 1.838 . . . . 0.0 111.983 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.1 t -113.99 134.98 54.49 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.679 1.191 . . . . 0.0 112.853 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -138.8 159.06 43.03 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 0.0 112.604 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -80.49 162.69 24.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -171.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -143.47 142.34 20.95 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.48 1.512 . . . . 0.0 112.318 178.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -81.15 -12.22 11.83 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.054 3.169 . . . . 0.0 115.076 -174.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 . . . . . 0 C--O 1.258 1.519 0 CA-C-O 116.71 -1.614 . . . . 0.0 113.446 176.602 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 118.078 -0.963 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -144.61 155.12 43.47 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.832 0.853 . . . . 0.0 112.112 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.0 m -78.91 70.33 5.23 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.191 0.996 . . . . 0.0 109.097 166.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.86 3.26 10.4 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -171.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp 37.33 -67.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.442 1 C-N-CA 135.624 5.569 . . . . 0.0 113.905 172.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 mtm105 -57.17 -49.13 76.93 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.68 1.592 . . . . 0.0 111.384 171.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -81.61 -29.49 33.26 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.432 1.093 . . . . 0.0 112.19 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.2 t -57.33 -49.37 76.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 122.948 0.499 . . . . 0.0 111.438 175.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.12 -47.23 75.29 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.466 1.506 . . . . 0.0 112.185 176.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.1 mt -66.6 -32.66 74.13 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -64.1 -47.12 81.25 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 122.41 0.284 . . . . 0.0 110.953 170.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.9 m -63.54 -23.5 67.42 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -60.76 -16.72 43.28 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.628 -1.295 . . . . 0.0 113.426 171.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.8 p -51.35 -33.84 31.28 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.384 0.993 . . . . 0.0 112.767 169.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.4 mt -113.01 11.15 18.93 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.757 1.223 . . . . 0.0 112.365 173.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 22.81 72.97 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.292 1.425 . . . . 0.0 113.943 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.3 mt -100.76 161.61 13.48 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.405 1.082 . . . . 0.0 113.043 -170.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.6 mt -79.54 143.4 34.86 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.716 1.606 . . . . 0.0 108.803 166.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.02 130.25 9.68 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 124.961 1.267 . . . . 0.0 112.533 178.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -138.38 156.66 47.39 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.18 1.392 . . . . 0.0 112.636 -172.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.14 137.02 32.7 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.449 1.1 . . . . 0.0 112.431 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 9.1 pt -135.31 44.53 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.699 1.199 . . . . 0.0 113.36 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 91.51 0.52 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.025 1.297 . . . . 0.0 110.827 -176.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 65.76 -6.89 0.39 Allowed 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 127.637 2.375 . . . . 0.0 117.097 175.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -133.09 142.73 48.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.076 1.35 . . . . 0.0 111.367 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.41 134.7 36.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.285 1.434 . . . . 0.0 111.386 172.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -144.21 135.17 25.24 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.78 0.832 . . . . 0.0 111.318 170.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -76.64 167.23 22.19 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.478 1.111 . . . . 0.0 113.09 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.4 m -141.55 142.66 26.85 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 112.428 -176.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.38 -4.5 15.52 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 124.393 3.395 . . . . 0.0 116.587 -169.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 32.0 m80 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 128.592 2.757 . . . . 0.0 116.825 -173.546 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -68.16 174.44 3.9 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.041 1.336 . . . . 0.0 113.644 -177.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 m -70.12 48.75 0.1 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.207 1.403 . . . . 0.0 114.69 177.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -51.89 -48.62 64.01 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 123.47 1.605 . . . . 0.0 113.898 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? 62.8 -56.53 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 1 C-N-CA 133.45 4.7 . . . . 0.0 111.61 -173.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.32 -54.36 34.23 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.214 1.006 . . . . 0.0 112.277 -176.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -74.51 -30.87 61.97 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.84 172.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.5 t -58.45 -40.85 83.73 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.958 0.903 . . . . 0.0 112.886 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.62 -35.22 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.1 mt -59.44 -38.37 80.53 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.556 0.616 . . . . 0.0 112.128 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 m -79.75 -18.77 50.32 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.282 1.433 . . . . 0.0 113.793 177.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.3 m -85.42 -34.67 21.65 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.331 1.053 . . . . 0.0 112.892 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.4 mtp180 -51.91 -32.42 32.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.493 1.117 . . . . 0.0 112.659 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -61.61 -10.3 7.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.099 2.16 . . . . 0.0 116.289 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -126.34 7.0 7.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.726 1.21 . . . . 0.0 112.997 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.03 44.51 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.306 0.955 . . . . 0.0 114.325 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.7 mt -115.43 163.6 15.49 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.66 1.23 . . . . 0.0 112.799 -171.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.7 mt -108.81 155.84 20.32 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 126.091 1.756 . . . . 0.0 109.16 167.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -89.19 142.03 16.59 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 123.623 0.63 . . . . 0.0 111.652 172.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -137.53 134.13 35.33 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.087 1.355 . . . . 0.0 111.468 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -74.7 139.18 43.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.224 1.41 . . . . 0.0 111.681 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.3 pt -138.57 57.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 126.74 2.016 . . . . 0.0 111.224 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.11 91.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.731 0 C-N-CA 125.415 1.483 . . . . 0.0 112.4 177.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 64.19 2.88 1.58 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.229 1.812 . . . . 0.0 115.356 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -140.2 141.69 35.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.784 1.634 . . . . 0.0 111.917 -178.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.9 t -112.7 143.9 43.12 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.586 1.154 . . . . 0.0 112.395 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -152.2 155.71 38.31 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.207 2.203 . . . . 0.0 110.169 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.6 m -83.73 159.25 21.52 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -173.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.8 m -145.87 144.34 21.87 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 125.269 1.428 . . . . 0.0 112.376 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -82.09 -4.52 11.91 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.092 3.194 . . . . 0.0 113.356 176.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 125.548 1.539 . . . . 0.0 113.974 -174.495 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 110.595 -0.15 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -123.33 170.42 10.33 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.647 1.179 . . . . 0.0 111.622 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.4 m -72.87 117.44 14.58 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -66.78 -43.8 83.02 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 124.808 2.242 . . . . 0.0 113.075 173.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.4 tm? 62.34 -49.19 0.17 Allowed 'General case' 0 C--N 1.319 -0.73 1 C-N-CA 133.682 4.793 . . . . 0.0 113.532 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -73.39 -56.13 5.46 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.849 0.75 . . . . 0.0 110.842 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -60.74 -31.89 71.2 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.51 -0.744 . . . . 0.0 112.075 171.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.79 -52.32 66.2 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 168.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.404 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 89.6 mt-10 -60.16 -35.21 74.82 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.803 -1.185 . . . . 0.0 113.773 176.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.68 -46.63 78.33 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.922 0.889 . . . . 0.0 111.813 174.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -65.86 -41.57 91.48 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.043 -0.411 . . . . 0.0 111.707 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m -59.45 -29.07 67.53 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.271 -0.893 . . . . 0.0 113.307 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -61.11 -18.29 57.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 177.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -57.99 -27.65 63.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.148 1.34 . . . . 0.0 113.25 174.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -113.15 21.07 15.7 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.699 1.599 . . . . 0.0 111.731 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.44 -8.74 12.32 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.549 2.023 . . . . 0.0 116.143 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.41 161.13 31.23 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.25 1.82 . . . . 0.0 113.078 -169.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.2 mt -99.71 152.56 19.95 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.133 0.973 . . . . 0.0 109.416 165.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.404 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -99.32 141.69 15.65 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 124.84 1.21 . . . . 0.0 112.138 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 139.76 40.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.153 1.381 . . . . 0.0 110.127 172.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.4 t -75.62 128.37 35.1 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.86 0.864 . . . . 0.0 110.798 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -139.41 117.23 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.41 45.14 97.02 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 121.875 -0.516 . . . . 0.0 113.257 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 60.44 10.59 2.54 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -124.95 120.77 32.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.765 1.226 . . . . 0.0 110.606 170.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.4 t -74.85 132.28 41.39 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 174.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -126.43 153.76 44.59 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.085 1.754 . . . . 0.0 109.842 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.0 m -80.89 161.27 24.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.457 0.703 . . . . 0.0 111.324 170.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.78 138.23 32.66 Favored Pre-proline 0 N--CA 1.481 1.116 0 O-C-N 121.572 -0.705 . . . . 0.0 110.682 -178.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -72.05 -9.59 24.79 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 123.818 3.012 . . . . 0.0 115.07 -168.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.1 m80 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.486 1.914 . . . . 0.0 115.875 -175.696 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -137.67 -153.5 0.49 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.0 1.32 . . . . 0.0 112.674 -169.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.3 m -69.89 123.63 21.97 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.617 1.567 . . . . 0.0 113.323 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -66.74 -49.2 66.75 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 124.275 1.988 . . . . 0.0 112.052 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.9 tp 61.58 -51.1 0.13 Allowed 'General case' 0 C--N 1.32 -0.688 1 C-N-CA 133.157 4.583 . . . . 0.0 113.052 -171.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 71.3 mtm180 -73.84 -36.27 64.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -174.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -83.01 -36.54 24.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.039 1.736 . . . . 0.0 111.446 168.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.2 t -52.27 -45.73 65.54 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.071 0.548 . . . . 0.0 112.073 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.24 -39.38 72.46 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.155 0.982 . . . . 0.0 113.206 173.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.49 -39.17 77.81 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.014 0.926 . . . . 0.0 112.34 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -66.81 -39.21 87.63 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.436 0.694 . . . . 0.0 111.54 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.6 m -65.39 -34.63 78.76 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.961 0.904 . . . . 0.0 113.241 171.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -61.5 -25.66 67.41 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.162 0.985 . . . . 0.0 112.924 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.1 m -64.44 -10.94 28.46 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 172.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -126.63 4.6 6.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.468 1.907 . . . . 0.0 112.33 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.56 28.59 69.16 Favored Glycine 0 CA--C 1.532 1.15 0 O-C-N 121.318 -0.864 . . . . 0.0 114.24 -173.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.7 mt -109.45 167.95 9.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.427 1.491 . . . . 0.0 111.425 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 mt -112.0 142.47 44.38 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 108.914 168.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -105.43 136.32 13.11 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.606 1.098 . . . . 0.0 112.756 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -145.79 157.54 43.92 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.048 0.924 . . . . 0.0 112.533 170.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.73 123.29 28.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.7 0.8 . . . . 0.0 111.99 -177.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mm -88.6 60.2 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.447 1.499 . . . . 0.0 109.206 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.84 -54.51 2.99 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 126.242 1.877 . . . . 0.0 113.831 -170.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -153.75 11.26 0.43 Allowed 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -174.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -136.9 128.86 29.29 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.586 1.555 . . . . 0.0 107.953 168.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.8 t -81.71 150.73 27.85 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.171 -0.956 . . . . 0.0 111.772 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -150.26 135.52 17.96 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.002 0.521 . . . . 0.0 112.05 -173.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.3 m -82.11 155.41 25.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.861 0.864 . . . . 0.0 112.714 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.6 m -148.23 143.41 17.49 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 124.876 1.27 . . . . 0.0 111.365 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -77.66 -9.01 17.17 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.769 2.98 . . . . 0.0 115.333 -171.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.0 m80 . . . . . 0 C--O 1.249 1.074 0 C-N-CA 127.151 2.18 . . . . 0.0 113.999 -173.743 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -142.38 166.35 24.91 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.83 1.652 . . . . 0.0 111.082 176.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.4 m -71.63 149.79 45.26 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -92.56 167.2 12.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.797 1.239 . . . . 0.0 108.493 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.93 -53.04 0.47 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.37 169.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -59.59 -56.82 17.05 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.124 0.875 . . . . 0.0 112.085 169.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -66.15 -37.96 86.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.688 1.131 . . . . 0.0 112.624 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.6 t -60.57 -49.4 77.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.027 0.931 . . . . 0.0 111.878 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -63.08 -40.68 98.37 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 117.641 -1.171 . . . . 0.0 112.299 176.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.73 -45.93 88.54 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.651 1.569 . . . . 0.0 111.731 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 68.6 m -64.47 -32.39 74.0 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.1 m -82.74 -47.51 11.88 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -62.09 -20.26 63.83 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.937 1.295 . . . . 0.0 112.057 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -62.59 -23.72 67.19 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 171.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.2 mt -110.06 14.18 23.03 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.619 1.568 . . . . 0.0 111.995 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.35 20.13 76.57 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.738 1.161 . . . . 0.0 114.383 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.2 mt -92.77 162.23 14.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.522 1.529 . . . . 0.0 111.317 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -92.93 141.17 28.71 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.135 0.974 . . . . 0.0 108.781 167.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.3 132.34 11.08 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 124.808 1.194 . . . . 0.0 111.922 177.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.7 154.89 34.96 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.208 1.003 . . . . 0.0 112.849 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.5 t -91.18 132.17 36.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.536 1.134 . . . . 0.0 112.082 -174.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -75.13 -37.25 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.759 0.823 . . . . 0.0 110.604 170.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 165.48 -38.07 0.27 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 126.113 1.816 . . . . 0.0 111.839 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -148.82 7.53 0.74 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.064 2.145 . . . . 0.0 113.278 169.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.62 132.65 52.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.409 1.883 . . . . 0.0 111.325 173.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.06 141.42 45.73 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.437 1.095 . . . . 0.0 111.97 172.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -131.03 141.35 50.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.095 2.158 . . . . 0.0 111.105 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.1 m -103.87 153.7 20.46 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.077 0.951 . . . . 0.0 112.003 169.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.9 m -148.4 144.5 18.7 Favored Pre-proline 0 N--CA 1.484 1.229 0 C-N-CA 124.428 1.091 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -87.88 -14.57 3.5 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.722 2.948 . . . . 0.0 114.187 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--O 1.252 1.212 0 C-N-CA 126.562 1.945 . . . . 0.0 116.192 -168.562 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -145.15 145.32 31.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.286 1.435 . . . . 0.0 112.297 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -70.13 151.13 45.79 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -93.83 178.93 5.51 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 162.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.78 -66.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.5 tpp85 -59.46 -49.05 79.3 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.067 0.849 . . . . 0.0 112.287 177.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -62.13 -35.21 78.06 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.057 0.943 . . . . 0.0 112.299 177.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -71.09 -50.54 32.61 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.221 1.408 . . . . 0.0 111.321 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.79 -37.19 75.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.864 1.666 . . . . 0.0 112.54 176.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.09 -40.34 82.68 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.775 1.23 . . . . 0.0 112.811 174.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.8 t -58.42 -46.77 85.82 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 169.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 78.2 m -68.97 -31.43 70.29 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -56.61 -33.73 66.54 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.801 1.24 . . . . 0.0 111.731 174.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.5 m -68.9 -3.15 11.59 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.8 mt -125.18 7.01 7.84 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 120.127 1.331 . . . . 0.0 111.769 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.9 27.76 71.73 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.799 1.19 . . . . 0.0 113.956 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.2 mt -110.15 161.61 15.4 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.049 1.74 . . . . 0.0 112.076 -178.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -96.96 148.91 22.49 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.579 1.151 . . . . 0.0 108.9 166.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -96.48 140.95 15.34 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.189 1.376 . . . . 0.0 112.126 174.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -136.12 134.56 38.46 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.961 1.704 . . . . 0.0 111.06 -178.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.5 t -76.89 137.88 39.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.188 0.595 . . . . 0.0 112.306 173.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -121.72 75.74 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.493 1.517 . . . . 0.0 108.853 172.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.35 -55.11 2.81 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.306 1.908 . . . . 0.0 114.526 175.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -146.91 -0.83 0.7 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.932 1.293 . . . . 0.0 114.326 -174.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -142.86 134.33 26.33 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.302 1.041 . . . . 0.0 110.776 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.8 t -97.13 138.77 34.13 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.007 0.923 . . . . 0.0 112.29 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -137.66 162.85 32.74 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.388 1.875 . . . . 0.0 112.066 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.5 m -80.32 161.83 24.86 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.64 143.43 32.41 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 123.404 0.682 . . . . 0.0 112.064 -176.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.63 -1.79 11.79 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.883 3.056 . . . . 0.0 114.529 -172.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.9 m80 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 125.158 1.383 . . . . 0.0 113.696 -169.525 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -72.45 88.46 1.21 Allowed 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.853 -1.154 . . . . 0.0 111.614 178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t -81.43 54.51 2.35 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.801 2.04 . . . . 0.0 111.831 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -72.68 163.71 27.65 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.873 -1.142 . . . . 0.0 110.445 169.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -134.29 -71.33 0.5 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.254 1.021 . . . . 0.0 109.432 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 -55.17 -38.63 68.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.835 1.254 . . . . 0.0 112.919 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -86.75 -30.12 21.84 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.26 1.424 . . . . 0.0 113.817 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.6 t -62.78 -37.32 86.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.79 0.436 . . . . 0.0 111.424 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -52.1 -32.13 33.72 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.1 mt -78.25 -26.99 47.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.712 1.205 . . . . 0.0 112.337 -178.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.1 m -74.86 -41.94 58.87 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.546 0.738 . . . . 0.0 110.581 168.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.415 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.3 m -68.51 -23.46 64.55 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.399 1.079 . . . . 0.0 113.195 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -52.5 -26.11 12.1 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.311 1.844 . . . . 0.0 113.536 174.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 t -53.86 -34.33 59.01 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.3 mt -119.91 21.98 11.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.722 1.609 . . . . 0.0 112.157 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.09 23.95 71.56 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 123.972 0.796 . . . . 0.0 114.557 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 18.0 mt -94.01 163.93 13.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.131 1.372 . . . . 0.0 110.702 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -105.69 159.98 15.57 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.389 1.076 . . . . 0.0 108.398 166.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.57 138.47 13.94 Favored Glycine 0 CA--C 1.528 0.858 0 CA-C-O 118.622 -1.099 . . . . 0.0 111.671 177.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -137.29 135.58 37.25 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.827 2.051 . . . . 0.0 109.302 175.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.59 136.02 34.92 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.153 -0.967 . . . . 0.0 111.287 173.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.6 mt -120.72 100.46 9.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 124.883 1.273 . . . . 0.0 108.58 175.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 -66.98 2.4 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 127.222 2.344 . . . . 0.0 112.112 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -159.2 16.97 0.17 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.331 1.452 . . . . 0.0 112.974 -170.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -149.28 133.54 17.38 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.918 1.287 . . . . 0.0 110.315 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -84.04 133.28 34.67 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -118.35 156.67 28.53 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 127.994 2.518 . . . . 0.0 109.787 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -95.29 156.67 16.22 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.478 0.711 . . . . 0.0 112.442 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.2 m -142.0 140.89 20.33 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -85.97 70.55 4.58 Favored 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.755 4.304 . . . . 0.0 110.939 176.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.6 p80 . . . . . 0 C--O 1.25 1.111 0 C-N-CA 129.51 3.124 . . . . 0.0 117.491 -173.822 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 110.213 -0.291 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -142.26 131.14 22.94 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.736 0.814 . . . . 0.0 112.176 178.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 56.2 m -76.29 115.85 16.41 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.056 1.742 . . . . 0.0 113.457 -178.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -76.6 172.75 12.51 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.457 -0.777 . . . . 0.0 109.387 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.17 -59.51 1.04 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.423 168.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -62.29 -51.71 66.59 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.877 1.217 . . . . 0.0 112.07 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -65.0 -28.98 69.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.4 0.68 . . . . 0.0 112.068 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.3 t -68.06 -49.36 61.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 117.878 0.308 . . . . 0.0 111.114 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.85 -37.88 83.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.124 1.369 . . . . 0.0 112.545 174.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.07 -39.78 94.82 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.962 0.905 . . . . 0.0 112.471 172.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.9 m -68.95 -46.53 67.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.09 0.556 . . . . 0.0 111.583 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.5 m -62.72 -19.2 63.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.729 1.212 . . . . 0.0 114.051 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -55.56 -21.81 18.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.385 1.074 . . . . 0.0 112.522 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -56.12 -22.34 27.73 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.724 1.21 . . . . 0.0 114.003 173.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.9 mt -120.4 10.73 11.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.537 1.535 . . . . 0.0 112.881 170.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.88 24.87 76.65 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 124.674 1.131 . . . . 0.0 113.839 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.7 mt -97.84 168.59 10.22 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.985 1.314 . . . . 0.0 111.55 -177.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -106.24 171.95 7.07 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 164.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.72 138.45 9.95 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 123.902 0.763 . . . . 0.0 113.213 -168.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -142.16 144.9 33.66 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.744 1.617 . . . . 0.0 111.661 -173.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.64 157.05 34.23 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.651 1.58 . . . . 0.0 114.222 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 15.5 mt -140.35 78.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 128.168 2.587 . . . . 0.0 107.243 168.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -56.08 0.42 Allowed Glycine 0 CA--C 1.536 1.397 0 C-N-CA 128.442 2.925 . . . . 0.0 115.086 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -145.3 -8.28 0.6 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.716 2.006 . . . . 0.0 114.638 -176.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -111.76 129.34 56.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.331 1.452 . . . . 0.0 109.897 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.9 t -99.42 127.37 45.45 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.507 1.049 . . . . 0.0 111.922 174.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -131.2 145.08 51.79 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.078 1.751 . . . . 0.0 112.23 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.6 m -84.33 159.79 20.83 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.53 142.86 24.41 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.223 1.009 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -77.89 -4.1 14.14 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 124.667 3.578 . . . . 0.0 113.193 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.9 m80 . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.236 1.815 . . . . 0.0 114.097 -175.664 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.796 0 N-CA-C 111.275 0.102 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -46.41 130.05 10.77 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.942 2.097 . . . . 0.0 115.12 -173.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.3 t -88.62 122.12 31.72 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.243 1.017 . . . . 0.0 108.972 169.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -87.91 155.01 20.07 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.25 -0.907 . . . . 0.0 111.958 -174.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.61 -64.71 0.74 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.782 0.833 . . . . 0.0 109.439 174.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -59.78 -36.06 75.91 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -81.29 -35.1 31.48 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 119.306 0.957 . . . . 0.0 113.202 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.9 t -64.25 -42.83 96.33 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -56.21 -32.67 64.62 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 120.819 -1.175 . . . . 0.0 112.264 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 69.5 mt -73.69 -29.24 62.17 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.872 1.269 . . . . 0.0 113.435 175.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.2 t -69.92 -47.84 60.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.29 0.636 . . . . 0.0 110.578 169.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.6 m -59.62 -35.38 74.23 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.63 -0.669 . . . . 0.0 112.668 177.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -56.12 -23.18 32.7 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.149 1.38 . . . . 0.0 113.546 174.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.4 t -59.79 -28.25 67.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.302 1.041 . . . . 0.0 113.581 172.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -113.44 18.75 17.48 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.035 1.734 . . . . 0.0 111.089 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.67 5.52 24.54 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 126.995 2.236 . . . . 0.0 115.349 -173.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.8 mt -75.31 165.63 24.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.178 1.791 . . . . 0.0 113.042 -173.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 tp -98.57 160.43 14.28 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.814 2.046 . . . . 0.0 108.806 168.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -130.64 145.05 16.46 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-N 120.272 1.396 . . . . 0.0 114.658 -178.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.46 147.36 32.11 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 126.422 1.889 . . . . 0.0 112.063 175.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 t -81.85 120.01 24.65 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.278 0.49 . . . . 0.0 112.065 176.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -89.07 -63.64 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.579 -0.701 . . . . 0.0 111.449 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -151.52 73.83 0.27 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 125.236 1.398 . . . . 0.0 110.446 -178.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 61.18 22.06 12.42 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.954 1.701 . . . . 0.0 113.735 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.87 129.22 13.8 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 125.891 1.676 . . . . 0.0 110.381 169.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.2 t -76.01 129.2 36.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.795 1.238 . . . . 0.0 112.342 175.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -106.09 137.68 43.59 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.648 1.979 . . . . 0.0 109.489 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.0 m -87.34 147.23 25.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.974 0.416 . . . . 0.0 112.038 169.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.3 m -141.64 142.22 25.15 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 124.281 1.032 . . . . 0.0 112.775 -168.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.56 9.39 4.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.644 3.563 . . . . 0.0 114.504 -171.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.5 m80 . . . . . 0 C--O 1.25 1.085 0 C-N-CA 126.157 1.783 . . . . 0.0 114.23 179.305 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 119.962 -0.066 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -78.37 157.63 29.03 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.93 0.892 . . . . 0.0 111.495 171.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.8 t -60.91 130.13 44.91 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.19 0.596 . . . . 0.0 112.048 175.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -94.06 159.31 15.22 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.241 -0.912 . . . . 0.0 110.85 169.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -127.82 -66.13 0.88 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.873 1.269 . . . . 0.0 108.624 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -62.73 -37.64 87.35 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.697 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -80.74 -33.01 35.43 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.987 0.812 . . . . 0.0 112.353 171.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.1 t -61.45 -42.32 98.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.825 0.739 . . . . 0.0 112.328 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -57.57 -22.29 43.94 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.755 -1.216 . . . . 0.0 113.813 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.1 mt -63.84 -24.97 67.96 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.539 1.063 . . . . 0.0 113.545 175.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -82.5 -44.66 15.68 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.949 -0.469 . . . . 0.0 111.175 169.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 79.6 m -67.6 -43.93 79.33 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.9 -18.25 65.21 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.115 0.966 . . . . 0.0 113.169 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.3 t -65.28 -24.12 67.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.463 0.705 . . . . 0.0 112.564 171.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -107.81 12.9 26.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.914 1.686 . . . . 0.0 111.904 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.57 22.56 77.91 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 125.294 1.426 . . . . 0.0 114.761 -176.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 mt -96.61 171.56 8.46 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.228 1.411 . . . . 0.0 112.701 -174.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.8 tp -108.3 147.28 31.68 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.198 2.599 . . . . 0.0 108.685 168.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.89 130.2 10.15 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.445 1.022 . . . . 0.0 113.057 173.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -140.0 149.44 43.23 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.28 1.832 . . . . 0.0 111.751 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.5 m -78.95 116.53 19.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.735 0.814 . . . . 0.0 111.875 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 7.8 tt -83.53 -11.25 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 125.732 1.613 . . . . 0.0 114.646 -172.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 175.3 -48.89 0.13 Allowed Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.944 1.735 . . . . 0.0 111.579 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -154.99 14.57 0.4 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.655 1.982 . . . . 0.0 112.566 168.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -142.05 146.9 36.0 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.237 1.815 . . . . 0.0 111.386 -175.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.9 t -86.37 127.0 34.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.69 0.677 . . . . 0.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -132.37 150.19 52.21 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.855 0.862 . . . . 0.0 112.777 172.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -87.77 149.11 24.39 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -169.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 m -146.28 144.07 20.51 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.127 1.371 . . . . 0.0 112.777 -174.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -88.76 0.69 6.35 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.304 3.336 . . . . 0.0 115.914 -170.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.1 m80 . . . . . 0 C--O 1.256 1.404 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -171.706 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -70.96 -178.61 1.98 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.373 1.469 . . . . 0.0 113.032 -173.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.2 t -71.1 45.43 0.09 Allowed 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 126.242 1.817 . . . . 0.0 115.273 -172.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.07 171.27 14.41 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.472 -1.392 . . . . 0.0 112.578 174.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -139.69 -59.52 0.56 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.312 1.045 . . . . 0.0 109.929 169.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.53 -23.36 66.86 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -93.64 -36.24 12.46 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.353 1.061 . . . . 0.0 112.514 169.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -67.49 -37.38 82.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.658 0.783 . . . . 0.0 113.084 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.87 -31.89 65.28 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.996 -1.065 . . . . 0.0 112.235 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 mt -64.79 -42.13 95.28 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.359 1.064 . . . . 0.0 112.895 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.8 p -78.09 -35.41 49.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.988 1.315 . . . . 0.0 112.416 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.1 m -70.48 -44.8 66.96 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 172.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -65.13 -21.89 66.85 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.595 -1.315 . . . . 0.0 112.894 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.6 m -61.46 -19.04 61.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 169.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.7 mt -112.18 13.62 20.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.406 1.882 . . . . 0.0 112.492 175.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 24.76 67.62 Favored Glycine 0 CA--C 1.54 1.621 0 C-N-CA 124.151 0.881 . . . . 0.0 115.266 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.1 mt -111.13 -179.15 3.65 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.457 2.303 . . . . 0.0 111.748 -174.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.8 mt -107.42 163.42 13.06 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.539 1.535 . . . . 0.0 107.96 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.92 132.03 9.63 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.53 1.538 . . . . 0.0 111.824 174.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -145.04 139.68 27.59 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.739 1.615 . . . . 0.0 111.285 -175.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.8 t -76.75 138.36 39.88 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.393 -0.817 . . . . 0.0 112.297 175.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.9 mm -82.39 -57.34 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.329 1.452 . . . . 0.0 110.728 170.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.04 -41.02 0.04 OUTLIER Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.158 0.885 . . . . 0.0 113.797 178.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -132.06 0.97 3.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.498 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -140.08 154.13 46.96 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.396 2.278 . . . . 0.0 110.296 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.1 t -110.87 137.31 48.67 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.54 0.736 . . . . 0.0 111.823 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -141.15 163.51 32.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.971 1.708 . . . . 0.0 110.627 -170.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.9 m -101.11 158.34 16.09 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -168.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -149.52 147.3 22.69 Favored Pre-proline 0 N--CA 1.483 1.189 0 C-N-CA 124.1 0.96 . . . . 0.0 113.466 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -84.22 63.24 6.84 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 125.297 3.998 . . . . 0.0 112.265 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.0 m80 . . . . . 0 C--O 1.252 1.224 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 172.802 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.035 0 CA-C-O 118.985 -0.531 . . . . 0.0 112.137 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -149.64 145.22 26.63 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 125.932 1.693 . . . . 0.0 113.284 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.5 m -87.38 120.65 28.89 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.75 1.62 . . . . 0.0 113.867 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -78.36 174.57 11.12 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.431 -0.793 . . . . 0.0 110.938 167.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.8 tt -142.62 -63.76 0.42 Allowed 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.698 -0.626 . . . . 0.0 110.252 168.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -39.15 81.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.055 0.942 . . . . 0.0 112.025 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -78.71 -33.08 47.1 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.99 1.268 . . . . 0.0 112.837 172.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.1 t -67.49 -40.82 85.26 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.863 0.865 . . . . 0.0 112.441 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -60.23 -42.11 94.55 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.783 -1.198 . . . . 0.0 112.275 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.6 mt -66.89 -41.49 87.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.243 1.017 . . . . 0.0 112.074 174.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.8 t -63.25 -45.31 92.14 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.466 1.107 . . . . 0.0 112.199 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -70.2 -31.53 69.03 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -63.67 -24.04 67.62 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.936 -1.103 . . . . 0.0 112.414 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -66.55 1.57 1.66 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 170.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -128.16 4.14 5.82 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.657 1.983 . . . . 0.0 111.48 167.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.11 31.41 38.83 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 126.382 1.944 . . . . 0.0 114.402 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -121.68 159.79 25.83 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.907 1.353 . . . . 0.0 112.6 -170.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.4 tp -87.39 148.64 24.92 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.016 1.727 . . . . 0.0 109.341 168.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -108.36 128.59 9.17 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.584 1.088 . . . . 0.0 113.411 175.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -141.99 143.15 33.06 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 127.563 2.345 . . . . 0.0 112.147 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.6 t -72.55 146.85 46.46 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.374 1.069 . . . . 0.0 113.137 174.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.3 pt -123.16 10.36 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 125.436 1.494 . . . . 0.0 114.37 171.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.15 -58.42 0.51 Allowed Glycine 0 CA--C 1.53 0.984 0 C-N-CA 125.373 1.463 . . . . 0.0 112.157 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -142.09 -0.11 1.32 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.85 1.26 . . . . 0.0 113.298 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -125.33 135.35 52.37 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.891 1.677 . . . . 0.0 109.774 170.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.7 t -90.29 117.29 28.92 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.956 -0.465 . . . . 0.0 110.05 168.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -102.59 165.85 10.85 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.869 1.268 . . . . 0.0 112.02 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -102.54 148.44 25.53 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.5 m -150.75 152.94 33.05 Favored Pre-proline 0 N--CA 1.478 0.966 0 C-N-CA 124.971 1.308 . . . . 0.0 112.417 -173.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -77.19 68.42 7.41 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.704 3.602 . . . . 0.0 110.424 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.9 m80 . . . . . 0 C--O 1.248 1.014 0 C-N-CA 128.626 2.77 . . . . 0.0 114.072 169.793 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.8 0 CA-C-O 119.346 -0.359 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -126.28 141.78 51.78 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.389 1.475 . . . . 0.0 110.826 172.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.5 t -91.13 116.94 29.2 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.907 1.283 . . . . 0.0 111.646 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.48 165.77 16.02 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.51 1.05 . . . . 0.0 111.958 173.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -133.55 -62.64 0.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 108.363 169.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 79.1 mtp85 -61.59 -38.08 86.25 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -88.86 -20.91 24.01 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 169.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.3 t -63.83 -42.17 97.68 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.159 0.891 . . . . 0.0 111.389 173.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -50.03 -42.01 48.6 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.479 1.112 . . . . 0.0 112.769 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.67 -30.39 70.7 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.672 1.189 . . . . 0.0 112.59 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -73.17 -48.47 35.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.937 0.895 . . . . 0.0 111.742 171.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.9 m -60.68 -31.5 70.75 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -62.43 -17.78 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.746 1.218 . . . . 0.0 114.162 175.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.3 p -57.53 -24.7 57.52 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.82 1.191 . . . . 0.0 114.03 170.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 77.7 mt -124.09 16.5 9.21 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.52 1.928 . . . . 0.0 112.044 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.49 25.6 70.21 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.362 0.982 . . . . 0.0 114.801 -177.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.4 mt -86.65 169.23 12.89 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.308 1.443 . . . . 0.0 111.763 -178.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -98.88 140.77 32.55 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.924 2.49 . . . . 0.0 108.412 168.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.08 136.57 12.76 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.424 1.011 . . . . 0.0 113.654 177.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -141.78 138.99 32.67 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.925 1.69 . . . . 0.0 112.277 177.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -77.36 133.86 38.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.709 0.804 . . . . 0.0 112.521 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.4 mm -86.35 -37.73 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.827 0.851 . . . . 0.0 112.011 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 170.55 -53.13 0.19 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.716 1.151 . . . . 0.0 112.829 175.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -123.24 -3.31 8.48 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.416 1.886 . . . . 0.0 112.921 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -150.04 144.63 25.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.322 1.849 . . . . 0.0 111.099 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.9 t -91.34 145.95 24.22 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.014 0.925 . . . . 0.0 113.439 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.5 tptt -128.78 132.36 47.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.304 2.642 . . . . 0.0 109.596 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -83.1 157.61 22.76 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.676 0.79 . . . . 0.0 113.094 176.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.1 m -149.9 147.59 22.9 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 125.839 1.655 . . . . 0.0 111.034 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -90.16 25.62 0.55 Allowed 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.765 2.976 . . . . 0.0 115.205 -169.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 . . . . . 0 C--O 1.253 1.253 0 CA-C-O 116.999 -1.477 . . . . 0.0 113.846 -179.009 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 120.729 0.299 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -87.51 36.55 0.75 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.195 1.398 . . . . 0.0 113.365 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -89.43 165.66 14.2 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.358 1.463 . . . . 0.0 114.294 -171.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -129.28 164.38 23.62 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.064 1.746 . . . . 0.0 110.662 169.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.6 tp -136.06 -61.34 0.71 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.152 0.981 . . . . 0.0 111.187 173.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.6 ttm-85 -61.18 -42.04 97.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.759 0.824 . . . . 0.0 112.26 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 tpp180 -68.42 -44.71 74.41 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.618 1.567 . . . . 0.0 111.866 168.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -55.36 -40.26 71.06 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.815 0.846 . . . . 0.0 112.377 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -61.26 -36.82 81.06 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.694 -1.254 . . . . 0.0 114.06 173.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 71.3 mt -71.03 -36.12 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.606 0.762 . . . . 0.0 111.846 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.3 m -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.465 1.106 . . . . 0.0 113.124 173.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.8 m -82.44 -12.53 57.8 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.0 mtm180 -53.73 -23.56 12.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.803 0.841 . . . . 0.0 112.655 167.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 99.0 p -41.85 -37.06 1.18 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.851 2.06 . . . . 0.0 114.915 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -133.35 19.07 3.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.708 2.003 . . . . 0.0 111.491 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.21 16.87 77.1 Favored Glycine 0 CA--C 1.537 1.435 0 C-N-CA 125.204 1.383 . . . . 0.0 115.178 -178.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.5 mt -94.43 166.93 11.82 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.653 1.581 . . . . 0.0 112.939 -170.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 mt -90.02 160.75 16.19 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.793 -1.094 . . . . 0.0 108.96 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -114.57 144.13 18.26 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.391 0.995 . . . . 0.0 112.701 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -140.99 151.76 44.38 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.226 1.81 . . . . 0.0 110.892 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 t -91.24 113.82 26.18 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 168.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.0 mt -129.7 104.77 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -174.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.49 54.85 17.43 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.124 0.868 . . . . 0.0 113.122 -175.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 60.37 18.42 8.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.962 1.705 . . . . 0.0 114.92 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -144.37 143.42 30.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.879 1.672 . . . . 0.0 112.409 176.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.9 t -70.67 137.7 50.04 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.807 1.243 . . . . 0.0 110.989 178.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -157.03 161.2 39.53 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.94 1.296 . . . . 0.0 111.764 168.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.5 m -94.33 159.92 14.91 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -169.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -147.79 148.92 31.89 Favored Pre-proline 0 N--CA 1.478 0.928 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -168.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -82.67 60.08 7.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.255 3.97 . . . . 0.0 112.648 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.1 m80 . . . . . 0 C--O 1.248 1.018 0 C-N-CA 127.735 2.414 . . . . 0.0 115.181 171.634 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 110.564 -0.161 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -72.11 156.6 39.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.911 1.284 . . . . 0.0 113.303 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 t -62.15 166.51 4.75 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.894 2.077 . . . . 0.0 114.342 -173.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -135.51 160.8 37.34 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.386 1.474 . . . . 0.0 110.095 168.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.6 tp -131.06 -67.87 0.69 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.91 0.884 . . . . 0.0 109.497 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -43.42 87.66 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.173 -0.918 . . . . 0.0 113.263 177.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -70.8 -40.61 72.42 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 118.863 0.756 . . . . 0.0 112.364 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.99 -44.35 87.12 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 117.695 0.225 . . . . 0.0 110.964 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -57.75 -33.61 68.66 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.982 1.313 . . . . 0.0 114.388 176.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 93.8 mt -70.92 -45.27 64.52 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.163 0.892 . . . . 0.0 111.497 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -62.17 -37.09 83.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.821 0.448 . . . . 0.0 111.632 171.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.4 m -67.26 -32.38 73.36 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 172.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -61.67 -25.87 67.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.817 -1.177 . . . . 0.0 112.42 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 m -61.85 -15.62 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 174.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -120.18 8.22 10.89 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 112.038 173.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.16 36.82 90.76 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.997 1.284 . . . . 0.0 113.755 -173.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.4 mt -109.24 159.93 16.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.663 1.185 . . . . 0.0 112.231 -177.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -89.77 150.12 22.42 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.864 2.065 . . . . 0.0 108.314 167.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.12 130.37 8.36 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 119.233 0.924 . . . . 0.0 111.763 174.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -134.67 147.2 50.08 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.786 1.634 . . . . 0.0 111.893 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.8 t -85.89 132.74 34.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 122.983 0.513 . . . . 0.0 111.2 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.3 pt -134.2 1.71 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -168.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.18 45.01 0.02 OUTLIER Glycine 0 N--CA 1.473 1.146 0 CA-C-N 119.484 1.038 . . . . 0.0 114.404 -173.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 62.02 25.11 15.03 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.008 1.323 . . . . 0.0 112.298 -169.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -158.32 147.56 19.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 128.202 2.601 . . . . 0.0 109.483 178.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -101.56 142.49 32.85 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 124.533 1.133 . . . . 0.0 111.813 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -127.85 134.17 49.4 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.821 1.248 . . . . 0.0 110.266 172.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.37 156.6 39.1 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 174.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.2 m -151.57 146.47 18.88 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 125.102 1.361 . . . . 0.0 111.646 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -81.08 62.68 8.6 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.867 3.045 . . . . 0.0 111.411 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.0 m80 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 127.94 2.496 . . . . 0.0 114.213 179.67 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -119.76 123.69 44.34 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.688 1.195 . . . . 0.0 110.899 177.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -89.68 115.08 26.79 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.301 1.04 . . . . 0.0 111.316 -169.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -92.35 166.51 12.54 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.737 -0.602 . . . . 0.0 109.938 167.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -130.38 -68.46 0.69 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 118.498 -0.763 . . . . 0.0 109.932 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -63.83 -47.3 81.33 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.934 1.243 . . . . 0.0 112.296 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -63.54 -38.2 90.21 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.563 0.62 . . . . 0.0 111.229 174.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.5 t -59.06 -46.01 89.33 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 172.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.61 -38.64 78.44 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.679 -1.263 . . . . 0.0 112.343 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.4 mt -71.72 -29.91 65.06 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -71.32 -39.53 71.33 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.901 0.881 . . . . 0.0 111.621 172.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 72.9 m -69.98 -27.98 65.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.709 1.204 . . . . 0.0 112.606 173.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 48.8 ttp85 -54.31 -32.48 56.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.925 1.29 . . . . 0.0 112.191 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.6 m -64.28 -7.19 8.58 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.0 mt -127.64 19.77 6.69 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.507 1.503 . . . . 0.0 111.723 169.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.88 20.7 70.8 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.203 0.906 . . . . 0.0 114.169 -175.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 31.4 mt -99.55 158.62 15.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.92 1.688 . . . . 0.0 111.662 -176.231 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -97.66 155.72 16.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.232 2.213 . . . . 0.0 109.157 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.53 125.61 6.77 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 124.231 0.92 . . . . 0.0 113.379 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -119.46 117.79 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.834 1.654 . . . . 0.0 111.129 179.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.0 t -73.25 122.03 21.3 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.804 -0.56 . . . . 0.0 110.428 172.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -87.33 -35.48 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 0.0 112.407 -174.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.79 -32.91 0.13 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.593 1.092 . . . . 0.0 114.925 173.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -138.32 -19.53 1.1 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.329 2.252 . . . . 0.0 111.908 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -134.64 148.49 50.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.226 1.811 . . . . 0.0 111.423 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -101.03 143.31 31.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.787 1.235 . . . . 0.0 112.93 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -119.87 141.77 49.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 127.223 2.209 . . . . 0.0 110.583 -175.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -91.14 152.31 20.63 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 171.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 m -153.65 153.89 29.57 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.501 1.52 . . . . 0.0 111.202 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.58 -17.8 26.17 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 121.832 1.688 . . . . 0.0 112.089 169.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 . . . . . 0 C--O 1.248 0.98 0 C-N-CA 127.064 2.146 . . . . 0.0 114.912 -174.837 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.475 0.178 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -113.43 153.6 28.35 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.33 1.452 . . . . 0.0 112.909 -174.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.55 134.61 52.74 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.746 1.618 . . . . 0.0 113.175 -175.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -93.33 159.64 15.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.256 1.022 . . . . 0.0 109.811 168.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -137.49 -65.24 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.341 0.656 . . . . 0.0 110.428 172.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.78 -23.78 66.42 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 177.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -89.1 -41.21 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.054 1.742 . . . . 0.0 111.99 169.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.3 t -58.93 -42.19 89.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.233 1.013 . . . . 0.0 112.159 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -56.95 -32.43 66.0 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.993 1.317 . . . . 0.0 114.111 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.0 mt -71.72 -40.27 69.57 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.632 -0.667 . . . . 0.0 111.732 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.5 t -73.83 -30.81 62.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.0 m -63.27 -36.68 84.48 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.088 -1.007 . . . . 0.0 113.13 172.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -59.07 -30.96 68.45 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.228 -0.92 . . . . 0.0 112.982 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -66.74 -14.3 62.4 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -114.79 6.62 15.58 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.53 1.532 . . . . 0.0 112.146 170.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.04 36.55 40.65 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.285 1.422 . . . . 0.0 114.609 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -123.34 160.78 26.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.595 1.558 . . . . 0.0 112.104 -169.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.6 mt -86.03 152.9 22.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.847 0.859 . . . . 0.0 108.728 165.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.56 128.94 9.71 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.855 0.741 . . . . 0.0 111.36 170.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -142.37 134.18 27.01 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.536 1.534 . . . . 0.0 111.653 -176.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 12.2 t -75.06 151.75 38.66 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -176.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.5 mt -97.98 -44.56 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.481 1.912 . . . . 0.0 109.689 169.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 168.69 -56.65 0.21 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.095 1.807 . . . . 0.0 110.905 177.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -126.71 11.12 7.22 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.371 1.468 . . . . 0.0 113.313 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -137.47 150.13 47.35 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 128.06 2.544 . . . . 0.0 109.887 168.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 39.2 t -105.38 147.28 28.38 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.778 0.831 . . . . 0.0 111.061 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -128.91 140.36 51.71 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.062 1.745 . . . . 0.0 111.038 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.2 m -88.86 146.79 24.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.246 0.618 . . . . 0.0 112.205 169.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.9 m -141.42 143.51 30.35 Favored Pre-proline 0 N--CA 1.482 1.127 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -84.29 57.3 5.21 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.582 3.521 . . . . 0.0 112.636 179.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 . . . . . 0 C--O 1.254 1.334 0 C-N-CA 127.833 2.453 . . . . 0.0 115.204 171.27 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 119.569 -0.253 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -52.29 160.42 0.8 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.629 1.172 . . . . 0.0 113.794 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.0 t -73.6 45.36 0.18 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.43 1.492 . . . . 0.0 114.139 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -68.51 159.28 32.1 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.442 -0.786 . . . . 0.0 109.332 168.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -127.06 -76.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.202 1.401 . . . . 0.0 109.128 171.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -64.71 -33.3 75.63 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 117.916 -1.04 . . . . 0.0 112.573 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -77.13 -33.52 56.77 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.151 0.981 . . . . 0.0 112.707 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.3 t -61.87 -42.89 99.6 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.844 0.747 . . . . 0.0 111.675 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -54.76 -32.06 59.46 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.229 1.012 . . . . 0.0 113.485 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.4 mt -69.71 -30.55 68.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.046 0.939 . . . . 0.0 112.88 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 72.2 m -75.11 -41.68 58.07 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.623 0.769 . . . . 0.0 110.866 169.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.418 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.8 m -65.5 -23.43 66.89 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.514 1.125 . . . . 0.0 113.682 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -51.21 -28.13 10.65 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.647 1.979 . . . . 0.0 113.087 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.9 t -51.33 -34.71 34.81 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.663 1.585 . . . . 0.0 113.586 175.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.1 mt -122.18 19.59 10.69 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.105 1.362 . . . . 0.0 112.646 -177.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.2 24.67 74.74 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.246 0.926 . . . . 0.0 114.088 -178.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.418 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 16.5 mt -102.02 159.58 15.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.449 1.5 . . . . 0.0 112.101 -175.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.7 mt -93.5 173.4 7.72 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 164.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -132.29 139.0 10.57 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -139.54 137.38 35.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.397 1.079 . . . . 0.0 110.215 -174.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.0 t -84.17 142.55 30.25 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 176.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.0 mt -142.72 117.52 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.782 1.633 . . . . 0.0 107.78 173.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.77 44.97 96.52 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.683 -0.635 . . . . 0.0 114.061 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 68.49 28.91 5.84 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -148.89 146.75 28.05 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.092 -1.63 . . . . 0.0 111.583 168.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -89.03 153.19 21.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 174.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -147.42 144.49 28.69 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.427 1.891 . . . . 0.0 110.362 172.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.6 m -83.85 153.43 24.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.75 143.35 14.01 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.45 1.5 . . . . 0.0 111.911 -177.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.76 -21.22 6.11 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.549 2.833 . . . . 0.0 114.52 -169.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 126.439 1.896 . . . . 0.0 114.026 -169.758 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -75.3 166.24 23.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 -170.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.3 t -74.96 59.21 0.9 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.608 1.563 . . . . 0.0 111.012 167.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -73.31 157.15 37.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.122 -0.986 . . . . 0.0 109.274 169.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -127.14 -72.09 0.65 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 117.879 -1.058 . . . . 0.0 110.988 171.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -62.01 -42.0 98.68 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 121.012 1.733 . . . . 0.0 112.922 173.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.3 mtt-85 -66.01 -35.95 81.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 118.757 0.708 . . . . 0.0 111.034 175.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.85 -42.42 97.57 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.103 0.961 . . . . 0.0 112.157 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 88.2 mt-10 -59.48 -29.83 68.11 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.927 -1.108 . . . . 0.0 112.909 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -72.52 -42.12 65.12 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.044 0.838 . . . . 0.0 112.595 170.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 m -62.28 -39.54 93.26 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.429 0.692 . . . . 0.0 111.637 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.0 m -70.73 -30.32 66.82 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.462 1.505 . . . . 0.0 113.405 175.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -57.0 -27.03 61.23 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.916 -1.115 . . . . 0.0 112.398 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.67 -17.84 50.07 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 175.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 98.8 mt -117.93 9.08 12.73 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.608 1.095 . . . . 0.0 112.914 170.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.13 18.39 74.62 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.73 1.157 . . . . 0.0 114.093 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 34.9 mt -95.06 176.51 6.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.06 1.744 . . . . 0.0 111.307 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.03 168.76 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.691 1.996 . . . . 0.0 108.076 165.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.424 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -116.62 149.22 18.81 Favored Glycine 0 N--CA 1.471 1.016 0 C-N-CA 124.165 0.888 . . . . 0.0 114.178 -172.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -138.38 133.95 33.54 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.297 1.839 . . . . 0.0 109.464 170.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.4 t -75.25 142.46 43.35 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.307 -0.871 . . . . 0.0 111.228 172.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.4 mm -93.86 -30.27 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.629 1.172 . . . . 0.0 111.689 175.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 162.08 -39.7 0.38 Allowed Glycine 0 N--CA 1.472 1.084 0 C-N-CA 125.709 1.624 . . . . 0.0 114.112 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -124.61 -10.21 7.35 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.398 1.479 . . . . 0.0 112.338 174.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -148.92 154.25 39.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.524 1.93 . . . . 0.0 110.9 -176.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -96.87 152.32 18.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.027 0.931 . . . . 0.0 113.056 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -130.59 143.78 50.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.537 1.535 . . . . 0.0 110.349 169.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -84.07 158.82 21.3 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 m -144.81 139.96 15.86 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 126.517 1.927 . . . . 0.0 110.739 -175.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -92.76 -24.22 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.741 2.961 . . . . 0.0 116.656 -168.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 C--O 1.253 1.282 0 C-N-CA 126.995 2.118 . . . . 0.0 113.201 -168.834 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 120.505 0.193 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -77.64 163.28 26.36 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.539 1.135 . . . . 0.0 111.245 168.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -67.01 162.48 21.99 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -178.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -126.98 174.33 8.94 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.056 1.343 . . . . 0.0 111.038 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.73 -73.57 0.43 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.31 1.044 . . . . 0.0 110.391 168.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.3 tpp85 -57.62 -45.74 85.01 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.365 1.438 . . . . 0.0 112.051 175.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.78 -28.42 67.59 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.382 -0.823 . . . . 0.0 113.037 176.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.4 t -67.95 -43.94 77.91 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.616 0.766 . . . . 0.0 111.586 169.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.37 -39.78 88.45 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.65 -1.281 . . . . 0.0 113.339 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -40.98 91.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.18 0.592 . . . . 0.0 111.69 175.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.9 t -63.43 -39.14 93.69 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 173.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 90.3 m -69.0 -12.21 61.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.035 1.334 . . . . 0.0 114.597 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -54.32 -26.48 29.8 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 121.162 -0.961 . . . . 0.0 112.532 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.5 t -54.97 -38.32 67.64 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -116.72 20.01 14.21 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.364 1.465 . . . . 0.0 113.579 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.52 25.82 73.77 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 120.92 -1.113 . . . . 0.0 115.029 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.8 mt -90.18 170.85 9.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.504 1.521 . . . . 0.0 111.353 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 mt -113.11 152.63 29.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.255 1.422 . . . . 0.0 110.037 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.41 131.07 9.93 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.235 0.921 . . . . 0.0 113.682 -172.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -131.25 141.04 49.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.022 1.329 . . . . 0.0 111.86 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.57 125.82 32.18 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.346 1.058 . . . . 0.0 111.911 -177.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -75.44 -47.25 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.626 1.17 . . . . 0.0 111.19 -177.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.44 -34.54 0.12 Allowed Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.613 1.578 . . . . 0.0 113.461 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -120.86 -26.02 5.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.629 1.972 . . . . 0.0 112.549 171.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -140.2 152.36 45.93 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.294 1.838 . . . . 0.0 111.983 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.1 t -113.99 134.98 54.49 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.679 1.191 . . . . 0.0 112.853 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -138.8 159.06 43.03 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 0.0 112.604 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -80.49 162.69 24.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -171.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -143.47 142.34 20.95 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.48 1.512 . . . . 0.0 112.318 178.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -81.15 -12.22 11.83 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.054 3.169 . . . . 0.0 115.076 -174.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 . . . . . 0 C--O 1.258 1.519 0 CA-C-O 116.71 -1.614 . . . . 0.0 113.446 176.602 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.0 m . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.86 3.26 10.4 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -171.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp 37.33 -67.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.442 1 C-N-CA 135.624 5.569 . . . . 0.0 113.905 172.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 mtm105 -57.17 -49.13 76.93 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.68 1.592 . . . . 0.0 111.384 171.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -81.61 -29.49 33.26 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.432 1.093 . . . . 0.0 112.19 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.2 t -57.33 -49.37 76.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 122.948 0.499 . . . . 0.0 111.438 175.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.12 -47.23 75.29 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.466 1.506 . . . . 0.0 112.185 176.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.1 mt -66.6 -32.66 74.13 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -64.1 -47.12 81.25 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 122.41 0.284 . . . . 0.0 110.953 170.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.9 m -63.54 -23.5 67.42 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -60.76 -16.72 43.28 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.628 -1.295 . . . . 0.0 113.426 171.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.8 p -51.35 -33.84 31.28 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.384 0.993 . . . . 0.0 112.767 169.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.4 mt -113.01 11.15 18.93 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.757 1.223 . . . . 0.0 112.365 173.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 22.81 72.97 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.292 1.425 . . . . 0.0 113.943 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.3 mt -100.76 161.61 13.48 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.405 1.082 . . . . 0.0 113.043 -170.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.6 mt -79.54 143.4 34.86 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.716 1.606 . . . . 0.0 108.803 166.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.02 130.25 9.68 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 124.961 1.267 . . . . 0.0 112.533 178.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -138.38 156.66 47.39 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.18 1.392 . . . . 0.0 112.636 -172.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.14 137.02 32.7 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.449 1.1 . . . . 0.0 112.431 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 9.1 pt -135.31 44.53 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.699 1.199 . . . . 0.0 113.36 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 91.51 0.52 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.025 1.297 . . . . 0.0 110.827 -176.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 65.76 -6.89 0.39 Allowed 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 127.637 2.375 . . . . 0.0 117.097 175.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -133.09 142.73 48.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.076 1.35 . . . . 0.0 111.367 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.41 134.7 36.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.285 1.434 . . . . 0.0 111.386 172.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -144.21 135.17 25.24 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.78 0.832 . . . . 0.0 111.318 170.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -76.64 167.23 22.19 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.478 1.111 . . . . 0.0 113.09 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.4 m -141.55 142.66 26.85 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 112.428 -176.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.38 -4.5 15.52 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 124.393 3.395 . . . . 0.0 116.587 -169.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 32.0 m80 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 128.592 2.757 . . . . 0.0 116.825 -173.546 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 m . . . . . 0 CA--C 1.548 0.884 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -51.89 -48.62 64.01 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 123.47 1.605 . . . . 0.0 113.898 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? 62.8 -56.53 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 1 C-N-CA 133.45 4.7 . . . . 0.0 111.61 -173.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.32 -54.36 34.23 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.214 1.006 . . . . 0.0 112.277 -176.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -74.51 -30.87 61.97 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.84 172.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.5 t -58.45 -40.85 83.73 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.958 0.903 . . . . 0.0 112.886 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.62 -35.22 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.1 mt -59.44 -38.37 80.53 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.556 0.616 . . . . 0.0 112.128 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 m -79.75 -18.77 50.32 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.282 1.433 . . . . 0.0 113.793 177.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 72.3 m -85.42 -34.67 21.65 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.331 1.053 . . . . 0.0 112.892 176.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.4 mtp180 -51.91 -32.42 32.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.493 1.117 . . . . 0.0 112.659 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -61.61 -10.3 7.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.099 2.16 . . . . 0.0 116.289 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -126.34 7.0 7.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.726 1.21 . . . . 0.0 112.997 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.03 44.51 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.306 0.955 . . . . 0.0 114.325 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.45 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 17.7 mt -115.43 163.6 15.49 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.66 1.23 . . . . 0.0 112.799 -171.015 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.7 mt -108.81 155.84 20.32 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 126.091 1.756 . . . . 0.0 109.16 167.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -89.19 142.03 16.59 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 123.623 0.63 . . . . 0.0 111.652 172.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -137.53 134.13 35.33 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.087 1.355 . . . . 0.0 111.468 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -74.7 139.18 43.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.224 1.41 . . . . 0.0 111.681 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.3 pt -138.57 57.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 126.74 2.016 . . . . 0.0 111.224 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.11 91.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.731 0 C-N-CA 125.415 1.483 . . . . 0.0 112.4 177.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 64.19 2.88 1.58 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.229 1.812 . . . . 0.0 115.356 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -140.2 141.69 35.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.784 1.634 . . . . 0.0 111.917 -178.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.9 t -112.7 143.9 43.12 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.586 1.154 . . . . 0.0 112.395 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -152.2 155.71 38.31 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.207 2.203 . . . . 0.0 110.169 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.6 m -83.73 159.25 21.52 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -173.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.8 m -145.87 144.34 21.87 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 125.269 1.428 . . . . 0.0 112.376 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -82.09 -4.52 11.91 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.092 3.194 . . . . 0.0 113.356 176.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 125.548 1.539 . . . . 0.0 113.974 -174.495 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.4 m . . . . . 0 CA--C 1.546 0.801 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -66.78 -43.8 83.02 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 124.808 2.242 . . . . 0.0 113.075 173.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.4 tm? 62.34 -49.19 0.17 Allowed 'General case' 0 C--N 1.319 -0.73 1 C-N-CA 133.682 4.793 . . . . 0.0 113.532 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -73.39 -56.13 5.46 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.849 0.75 . . . . 0.0 110.842 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -60.74 -31.89 71.2 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.51 -0.744 . . . . 0.0 112.075 171.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.79 -52.32 66.2 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 168.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 89.6 mt-10 -60.16 -35.21 74.82 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.803 -1.185 . . . . 0.0 113.773 176.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.68 -46.63 78.33 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.922 0.889 . . . . 0.0 111.813 174.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -65.86 -41.57 91.48 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.043 -0.411 . . . . 0.0 111.707 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m -59.45 -29.07 67.53 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.271 -0.893 . . . . 0.0 113.307 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -61.11 -18.29 57.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 177.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -57.99 -27.65 63.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.148 1.34 . . . . 0.0 113.25 174.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -113.15 21.07 15.7 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.699 1.599 . . . . 0.0 111.731 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.44 -8.74 12.32 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.549 2.023 . . . . 0.0 116.143 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.41 161.13 31.23 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.25 1.82 . . . . 0.0 113.078 -169.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.2 mt -99.71 152.56 19.95 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.133 0.973 . . . . 0.0 109.416 165.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -99.32 141.69 15.65 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 124.84 1.21 . . . . 0.0 112.138 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 139.76 40.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.153 1.381 . . . . 0.0 110.127 172.467 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.4 t -75.62 128.37 35.1 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.86 0.864 . . . . 0.0 110.798 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -139.41 117.23 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.41 45.14 97.02 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 121.875 -0.516 . . . . 0.0 113.257 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 60.44 10.59 2.54 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -124.95 120.77 32.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.765 1.226 . . . . 0.0 110.606 170.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.4 t -74.85 132.28 41.39 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 174.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -126.43 153.76 44.59 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.085 1.754 . . . . 0.0 109.842 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.0 m -80.89 161.27 24.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.457 0.703 . . . . 0.0 111.324 170.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.78 138.23 32.66 Favored Pre-proline 0 N--CA 1.481 1.116 0 O-C-N 121.572 -0.705 . . . . 0.0 110.682 -178.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -72.05 -9.59 24.79 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 123.818 3.012 . . . . 0.0 115.07 -168.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.1 m80 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.486 1.914 . . . . 0.0 115.875 -175.696 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.3 m . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -66.74 -49.2 66.75 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 124.275 1.988 . . . . 0.0 112.052 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.9 tp 61.58 -51.1 0.13 Allowed 'General case' 0 C--N 1.32 -0.688 1 C-N-CA 133.157 4.583 . . . . 0.0 113.052 -171.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 71.3 mtm180 -73.84 -36.27 64.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -174.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -83.01 -36.54 24.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.039 1.736 . . . . 0.0 111.446 168.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.2 t -52.27 -45.73 65.54 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.071 0.548 . . . . 0.0 112.073 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.24 -39.38 72.46 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.155 0.982 . . . . 0.0 113.206 173.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.49 -39.17 77.81 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.014 0.926 . . . . 0.0 112.34 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -66.81 -39.21 87.63 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.436 0.694 . . . . 0.0 111.54 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 71.6 m -65.39 -34.63 78.76 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.961 0.904 . . . . 0.0 113.241 171.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -61.5 -25.66 67.41 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.162 0.985 . . . . 0.0 112.924 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.1 m -64.44 -10.94 28.46 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 172.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -126.63 4.6 6.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.468 1.907 . . . . 0.0 112.33 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.56 28.59 69.16 Favored Glycine 0 CA--C 1.532 1.15 0 O-C-N 121.318 -0.864 . . . . 0.0 114.24 -173.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 18.7 mt -109.45 167.95 9.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.427 1.491 . . . . 0.0 111.425 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 mt -112.0 142.47 44.38 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 108.914 168.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -105.43 136.32 13.11 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.606 1.098 . . . . 0.0 112.756 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -145.79 157.54 43.92 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.048 0.924 . . . . 0.0 112.533 170.075 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.73 123.29 28.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.7 0.8 . . . . 0.0 111.99 -177.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mm -88.6 60.2 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.447 1.499 . . . . 0.0 109.206 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.84 -54.51 2.99 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 126.242 1.877 . . . . 0.0 113.831 -170.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -153.75 11.26 0.43 Allowed 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -174.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -136.9 128.86 29.29 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.586 1.555 . . . . 0.0 107.953 168.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.8 t -81.71 150.73 27.85 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.171 -0.956 . . . . 0.0 111.772 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -150.26 135.52 17.96 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.002 0.521 . . . . 0.0 112.05 -173.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.3 m -82.11 155.41 25.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.861 0.864 . . . . 0.0 112.714 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.6 m -148.23 143.41 17.49 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 124.876 1.27 . . . . 0.0 111.365 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -77.66 -9.01 17.17 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.769 2.98 . . . . 0.0 115.333 -171.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.0 m80 . . . . . 0 C--O 1.249 1.074 0 C-N-CA 127.151 2.18 . . . . 0.0 113.999 -173.743 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.4 m . . . . . 0 C--O 1.238 0.461 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -92.56 167.2 12.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.797 1.239 . . . . 0.0 108.493 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.93 -53.04 0.47 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.37 169.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -59.59 -56.82 17.05 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.124 0.875 . . . . 0.0 112.085 169.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -66.15 -37.96 86.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.688 1.131 . . . . 0.0 112.624 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.6 t -60.57 -49.4 77.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.027 0.931 . . . . 0.0 111.878 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -63.08 -40.68 98.37 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 117.641 -1.171 . . . . 0.0 112.299 176.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.73 -45.93 88.54 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.651 1.569 . . . . 0.0 111.731 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 68.6 m -64.47 -32.39 74.0 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.1 m -82.74 -47.51 11.88 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -62.09 -20.26 63.83 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.937 1.295 . . . . 0.0 112.057 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -62.59 -23.72 67.19 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 171.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.2 mt -110.06 14.18 23.03 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.619 1.568 . . . . 0.0 111.995 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.35 20.13 76.57 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.738 1.161 . . . . 0.0 114.383 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.2 mt -92.77 162.23 14.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.522 1.529 . . . . 0.0 111.317 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -92.93 141.17 28.71 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.135 0.974 . . . . 0.0 108.781 167.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.3 132.34 11.08 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 124.808 1.194 . . . . 0.0 111.922 177.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.7 154.89 34.96 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.208 1.003 . . . . 0.0 112.849 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.5 t -91.18 132.17 36.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.536 1.134 . . . . 0.0 112.082 -174.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -75.13 -37.25 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.759 0.823 . . . . 0.0 110.604 170.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 165.48 -38.07 0.27 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 126.113 1.816 . . . . 0.0 111.839 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -148.82 7.53 0.74 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.064 2.145 . . . . 0.0 113.278 169.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.62 132.65 52.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.409 1.883 . . . . 0.0 111.325 173.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.06 141.42 45.73 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.437 1.095 . . . . 0.0 111.97 172.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -131.03 141.35 50.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.095 2.158 . . . . 0.0 111.105 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.1 m -103.87 153.7 20.46 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.077 0.951 . . . . 0.0 112.003 169.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.9 m -148.4 144.5 18.7 Favored Pre-proline 0 N--CA 1.484 1.229 0 C-N-CA 124.428 1.091 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -87.88 -14.57 3.5 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.722 2.948 . . . . 0.0 114.187 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--O 1.252 1.212 0 C-N-CA 126.562 1.945 . . . . 0.0 116.192 -168.562 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -93.83 178.93 5.51 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 162.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.78 -66.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.5 tpp85 -59.46 -49.05 79.3 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.067 0.849 . . . . 0.0 112.287 177.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -62.13 -35.21 78.06 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.057 0.943 . . . . 0.0 112.299 177.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -71.09 -50.54 32.61 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.221 1.408 . . . . 0.0 111.321 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.79 -37.19 75.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.864 1.666 . . . . 0.0 112.54 176.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.09 -40.34 82.68 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.775 1.23 . . . . 0.0 112.811 174.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.8 t -58.42 -46.77 85.82 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 169.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 78.2 m -68.97 -31.43 70.29 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -56.61 -33.73 66.54 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.801 1.24 . . . . 0.0 111.731 174.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.5 m -68.9 -3.15 11.59 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.8 mt -125.18 7.01 7.84 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 120.127 1.331 . . . . 0.0 111.769 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.9 27.76 71.73 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.799 1.19 . . . . 0.0 113.956 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.417 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 16.2 mt -110.15 161.61 15.4 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.049 1.74 . . . . 0.0 112.076 -178.024 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -96.96 148.91 22.49 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.579 1.151 . . . . 0.0 108.9 166.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -96.48 140.95 15.34 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.189 1.376 . . . . 0.0 112.126 174.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -136.12 134.56 38.46 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.961 1.704 . . . . 0.0 111.06 -178.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.5 t -76.89 137.88 39.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.188 0.595 . . . . 0.0 112.306 173.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -121.72 75.74 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.493 1.517 . . . . 0.0 108.853 172.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.35 -55.11 2.81 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.306 1.908 . . . . 0.0 114.526 175.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -146.91 -0.83 0.7 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.932 1.293 . . . . 0.0 114.326 -174.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -142.86 134.33 26.33 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.302 1.041 . . . . 0.0 110.776 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.8 t -97.13 138.77 34.13 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.007 0.923 . . . . 0.0 112.29 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -137.66 162.85 32.74 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.388 1.875 . . . . 0.0 112.066 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.5 m -80.32 161.83 24.86 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.64 143.43 32.41 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 123.404 0.682 . . . . 0.0 112.064 -176.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.63 -1.79 11.79 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.883 3.056 . . . . 0.0 114.529 -172.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.9 m80 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 125.158 1.383 . . . . 0.0 113.696 -169.525 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t . . . . . 0 CA--C 1.55 0.971 0 CA-C-O 120.984 0.421 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -72.68 163.71 27.65 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.873 -1.142 . . . . 0.0 110.445 169.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -134.29 -71.33 0.5 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.254 1.021 . . . . 0.0 109.432 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 -55.17 -38.63 68.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.835 1.254 . . . . 0.0 112.919 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -86.75 -30.12 21.84 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.26 1.424 . . . . 0.0 113.817 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.6 t -62.78 -37.32 86.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.79 0.436 . . . . 0.0 111.424 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -52.1 -32.13 33.72 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.1 mt -78.25 -26.99 47.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.712 1.205 . . . . 0.0 112.337 -178.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.1 m -74.86 -41.94 58.87 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.546 0.738 . . . . 0.0 110.581 168.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.3 m -68.51 -23.46 64.55 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.399 1.079 . . . . 0.0 113.195 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -52.5 -26.11 12.1 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.311 1.844 . . . . 0.0 113.536 174.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 t -53.86 -34.33 59.01 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.3 mt -119.91 21.98 11.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.722 1.609 . . . . 0.0 112.157 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.09 23.95 71.56 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 123.972 0.796 . . . . 0.0 114.557 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 18.0 mt -94.01 163.93 13.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.131 1.372 . . . . 0.0 110.702 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -105.69 159.98 15.57 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.389 1.076 . . . . 0.0 108.398 166.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.57 138.47 13.94 Favored Glycine 0 CA--C 1.528 0.858 0 CA-C-O 118.622 -1.099 . . . . 0.0 111.671 177.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -137.29 135.58 37.25 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.827 2.051 . . . . 0.0 109.302 175.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.59 136.02 34.92 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.153 -0.967 . . . . 0.0 111.287 173.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.6 mt -120.72 100.46 9.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 124.883 1.273 . . . . 0.0 108.58 175.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 -66.98 2.4 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 127.222 2.344 . . . . 0.0 112.112 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -159.2 16.97 0.17 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.331 1.452 . . . . 0.0 112.974 -170.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -149.28 133.54 17.38 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.918 1.287 . . . . 0.0 110.315 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -84.04 133.28 34.67 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -118.35 156.67 28.53 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 127.994 2.518 . . . . 0.0 109.787 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -95.29 156.67 16.22 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.478 0.711 . . . . 0.0 112.442 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.2 m -142.0 140.89 20.33 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -85.97 70.55 4.58 Favored 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.755 4.304 . . . . 0.0 110.939 176.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.6 p80 . . . . . 0 C--O 1.25 1.111 0 C-N-CA 129.51 3.124 . . . . 0.0 117.491 -173.822 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.534 0.352 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -76.6 172.75 12.51 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.457 -0.777 . . . . 0.0 109.387 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.17 -59.51 1.04 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.423 168.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -62.29 -51.71 66.59 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.877 1.217 . . . . 0.0 112.07 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -65.0 -28.98 69.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.4 0.68 . . . . 0.0 112.068 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.3 t -68.06 -49.36 61.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 117.878 0.308 . . . . 0.0 111.114 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.85 -37.88 83.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.124 1.369 . . . . 0.0 112.545 174.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.07 -39.78 94.82 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.962 0.905 . . . . 0.0 112.471 172.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.9 m -68.95 -46.53 67.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.09 0.556 . . . . 0.0 111.583 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 85.5 m -62.72 -19.2 63.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.729 1.212 . . . . 0.0 114.051 176.177 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -55.56 -21.81 18.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.385 1.074 . . . . 0.0 112.522 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -56.12 -22.34 27.73 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.724 1.21 . . . . 0.0 114.003 173.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.9 mt -120.4 10.73 11.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.537 1.535 . . . . 0.0 112.881 170.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.88 24.87 76.65 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 124.674 1.131 . . . . 0.0 113.839 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 31.7 mt -97.84 168.59 10.22 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.985 1.314 . . . . 0.0 111.55 -177.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -106.24 171.95 7.07 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 164.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.72 138.45 9.95 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 123.902 0.763 . . . . 0.0 113.213 -168.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -142.16 144.9 33.66 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.744 1.617 . . . . 0.0 111.661 -173.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.64 157.05 34.23 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.651 1.58 . . . . 0.0 114.222 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 15.5 mt -140.35 78.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 128.168 2.587 . . . . 0.0 107.243 168.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -56.08 0.42 Allowed Glycine 0 CA--C 1.536 1.397 0 C-N-CA 128.442 2.925 . . . . 0.0 115.086 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -145.3 -8.28 0.6 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.716 2.006 . . . . 0.0 114.638 -176.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -111.76 129.34 56.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.331 1.452 . . . . 0.0 109.897 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.9 t -99.42 127.37 45.45 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.507 1.049 . . . . 0.0 111.922 174.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -131.2 145.08 51.79 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.078 1.751 . . . . 0.0 112.23 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.6 m -84.33 159.79 20.83 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.53 142.86 24.41 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.223 1.009 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -77.89 -4.1 14.14 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 124.667 3.578 . . . . 0.0 113.193 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.9 m80 . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.236 1.815 . . . . 0.0 114.097 -175.664 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.3 t . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -87.91 155.01 20.07 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.25 -0.907 . . . . 0.0 111.958 -174.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.61 -64.71 0.74 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.782 0.833 . . . . 0.0 109.439 174.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -59.78 -36.06 75.91 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -81.29 -35.1 31.48 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 119.306 0.957 . . . . 0.0 113.202 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.9 t -64.25 -42.83 96.33 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -56.21 -32.67 64.62 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 120.819 -1.175 . . . . 0.0 112.264 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 69.5 mt -73.69 -29.24 62.17 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.872 1.269 . . . . 0.0 113.435 175.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.2 t -69.92 -47.84 60.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.29 0.636 . . . . 0.0 110.578 169.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 76.6 m -59.62 -35.38 74.23 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.63 -0.669 . . . . 0.0 112.668 177.161 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -56.12 -23.18 32.7 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.149 1.38 . . . . 0.0 113.546 174.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.4 t -59.79 -28.25 67.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.302 1.041 . . . . 0.0 113.581 172.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -113.44 18.75 17.48 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.035 1.734 . . . . 0.0 111.089 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.67 5.52 24.54 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 126.995 2.236 . . . . 0.0 115.349 -173.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.443 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 32.8 mt -75.31 165.63 24.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.178 1.791 . . . . 0.0 113.042 -173.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 tp -98.57 160.43 14.28 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.814 2.046 . . . . 0.0 108.806 168.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -130.64 145.05 16.46 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-N 120.272 1.396 . . . . 0.0 114.658 -178.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.46 147.36 32.11 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 126.422 1.889 . . . . 0.0 112.063 175.19 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 t -81.85 120.01 24.65 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.278 0.49 . . . . 0.0 112.065 176.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -89.07 -63.64 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.579 -0.701 . . . . 0.0 111.449 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -151.52 73.83 0.27 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 125.236 1.398 . . . . 0.0 110.446 -178.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 61.18 22.06 12.42 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.954 1.701 . . . . 0.0 113.735 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.87 129.22 13.8 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 125.891 1.676 . . . . 0.0 110.381 169.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.2 t -76.01 129.2 36.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.795 1.238 . . . . 0.0 112.342 175.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -106.09 137.68 43.59 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.648 1.979 . . . . 0.0 109.489 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.0 m -87.34 147.23 25.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.974 0.416 . . . . 0.0 112.038 169.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.3 m -141.64 142.22 25.15 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 124.281 1.032 . . . . 0.0 112.775 -168.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.56 9.39 4.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.644 3.563 . . . . 0.0 114.504 -171.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.5 m80 . . . . . 0 C--O 1.25 1.085 0 C-N-CA 126.157 1.783 . . . . 0.0 114.23 179.305 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.548 0.888 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -94.06 159.31 15.22 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.241 -0.912 . . . . 0.0 110.85 169.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -127.82 -66.13 0.88 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.873 1.269 . . . . 0.0 108.624 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -62.73 -37.64 87.35 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.697 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -80.74 -33.01 35.43 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.987 0.812 . . . . 0.0 112.353 171.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.1 t -61.45 -42.32 98.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.825 0.739 . . . . 0.0 112.328 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -57.57 -22.29 43.94 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.755 -1.216 . . . . 0.0 113.813 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.1 mt -63.84 -24.97 67.96 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.539 1.063 . . . . 0.0 113.545 175.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -82.5 -44.66 15.68 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.949 -0.469 . . . . 0.0 111.175 169.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 79.6 m -67.6 -43.93 79.33 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.9 -18.25 65.21 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.115 0.966 . . . . 0.0 113.169 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.3 t -65.28 -24.12 67.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.463 0.705 . . . . 0.0 112.564 171.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -107.81 12.9 26.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.914 1.686 . . . . 0.0 111.904 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.57 22.56 77.91 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 125.294 1.426 . . . . 0.0 114.761 -176.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.45 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 27.8 mt -96.61 171.56 8.46 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.228 1.411 . . . . 0.0 112.701 -174.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.8 tp -108.3 147.28 31.68 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.198 2.599 . . . . 0.0 108.685 168.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.89 130.2 10.15 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.445 1.022 . . . . 0.0 113.057 173.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -140.0 149.44 43.23 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.28 1.832 . . . . 0.0 111.751 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.5 m -78.95 116.53 19.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.735 0.814 . . . . 0.0 111.875 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 7.8 tt -83.53 -11.25 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 125.732 1.613 . . . . 0.0 114.646 -172.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 175.3 -48.89 0.13 Allowed Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.944 1.735 . . . . 0.0 111.579 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -154.99 14.57 0.4 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.655 1.982 . . . . 0.0 112.566 168.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -142.05 146.9 36.0 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.237 1.815 . . . . 0.0 111.386 -175.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.9 t -86.37 127.0 34.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.69 0.677 . . . . 0.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -132.37 150.19 52.21 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.855 0.862 . . . . 0.0 112.777 172.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -87.77 149.11 24.39 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -169.019 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 m -146.28 144.07 20.51 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.127 1.371 . . . . 0.0 112.777 -174.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -88.76 0.69 6.35 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.304 3.336 . . . . 0.0 115.914 -170.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.1 m80 . . . . . 0 C--O 1.256 1.404 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -171.706 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.2 t . . . . . 0 CA--C 1.558 1.283 0 N-CA-C 115.273 1.582 . . . . 0.0 115.273 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.07 171.27 14.41 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.472 -1.392 . . . . 0.0 112.578 174.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -139.69 -59.52 0.56 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.312 1.045 . . . . 0.0 109.929 169.387 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.53 -23.36 66.86 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -93.64 -36.24 12.46 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.353 1.061 . . . . 0.0 112.514 169.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -67.49 -37.38 82.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.658 0.783 . . . . 0.0 113.084 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.87 -31.89 65.28 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.996 -1.065 . . . . 0.0 112.235 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 mt -64.79 -42.13 95.28 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.359 1.064 . . . . 0.0 112.895 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.8 p -78.09 -35.41 49.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.988 1.315 . . . . 0.0 112.416 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.1 m -70.48 -44.8 66.96 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 172.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -65.13 -21.89 66.85 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.595 -1.315 . . . . 0.0 112.894 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.6 m -61.46 -19.04 61.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 169.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.7 mt -112.18 13.62 20.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.406 1.882 . . . . 0.0 112.492 175.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 24.76 67.62 Favored Glycine 0 CA--C 1.54 1.621 0 C-N-CA 124.151 0.881 . . . . 0.0 115.266 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.1 mt -111.13 -179.15 3.65 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.457 2.303 . . . . 0.0 111.748 -174.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.8 mt -107.42 163.42 13.06 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.539 1.535 . . . . 0.0 107.96 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.92 132.03 9.63 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.53 1.538 . . . . 0.0 111.824 174.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -145.04 139.68 27.59 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.739 1.615 . . . . 0.0 111.285 -175.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.8 t -76.75 138.36 39.88 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.393 -0.817 . . . . 0.0 112.297 175.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.9 mm -82.39 -57.34 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.329 1.452 . . . . 0.0 110.728 170.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.04 -41.02 0.04 OUTLIER Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.158 0.885 . . . . 0.0 113.797 178.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -132.06 0.97 3.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.498 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -140.08 154.13 46.96 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.396 2.278 . . . . 0.0 110.296 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.1 t -110.87 137.31 48.67 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.54 0.736 . . . . 0.0 111.823 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -141.15 163.51 32.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.971 1.708 . . . . 0.0 110.627 -170.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.9 m -101.11 158.34 16.09 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -168.192 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -149.52 147.3 22.69 Favored Pre-proline 0 N--CA 1.483 1.189 0 C-N-CA 124.1 0.96 . . . . 0.0 113.466 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -84.22 63.24 6.84 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 125.297 3.998 . . . . 0.0 112.265 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.0 m80 . . . . . 0 C--O 1.252 1.224 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 172.802 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.5 m . . . . . 0 CA--C 1.546 0.8 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -78.36 174.57 11.12 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.431 -0.793 . . . . 0.0 110.938 167.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.8 tt -142.62 -63.76 0.42 Allowed 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.698 -0.626 . . . . 0.0 110.252 168.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -39.15 81.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.055 0.942 . . . . 0.0 112.025 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -78.71 -33.08 47.1 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.99 1.268 . . . . 0.0 112.837 172.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.1 t -67.49 -40.82 85.26 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.863 0.865 . . . . 0.0 112.441 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -60.23 -42.11 94.55 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.783 -1.198 . . . . 0.0 112.275 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.6 mt -66.89 -41.49 87.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.243 1.017 . . . . 0.0 112.074 174.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.8 t -63.25 -45.31 92.14 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.466 1.107 . . . . 0.0 112.199 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -70.2 -31.53 69.03 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -63.67 -24.04 67.62 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.936 -1.103 . . . . 0.0 112.414 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -66.55 1.57 1.66 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 170.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -128.16 4.14 5.82 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.657 1.983 . . . . 0.0 111.48 167.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.11 31.41 38.83 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 126.382 1.944 . . . . 0.0 114.402 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -121.68 159.79 25.83 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.907 1.353 . . . . 0.0 112.6 -170.405 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.4 tp -87.39 148.64 24.92 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.016 1.727 . . . . 0.0 109.341 168.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -108.36 128.59 9.17 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.584 1.088 . . . . 0.0 113.411 175.081 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -141.99 143.15 33.06 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 127.563 2.345 . . . . 0.0 112.147 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.6 t -72.55 146.85 46.46 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.374 1.069 . . . . 0.0 113.137 174.463 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.3 pt -123.16 10.36 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 125.436 1.494 . . . . 0.0 114.37 171.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.15 -58.42 0.51 Allowed Glycine 0 CA--C 1.53 0.984 0 C-N-CA 125.373 1.463 . . . . 0.0 112.157 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -142.09 -0.11 1.32 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.85 1.26 . . . . 0.0 113.298 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -125.33 135.35 52.37 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.891 1.677 . . . . 0.0 109.774 170.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.7 t -90.29 117.29 28.92 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.956 -0.465 . . . . 0.0 110.05 168.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -102.59 165.85 10.85 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.869 1.268 . . . . 0.0 112.02 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -102.54 148.44 25.53 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.5 m -150.75 152.94 33.05 Favored Pre-proline 0 N--CA 1.478 0.966 0 C-N-CA 124.971 1.308 . . . . 0.0 112.417 -173.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -77.19 68.42 7.41 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.704 3.602 . . . . 0.0 110.424 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.9 m80 . . . . . 0 C--O 1.248 1.014 0 C-N-CA 128.626 2.77 . . . . 0.0 114.072 169.793 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.5 t . . . . . 0 CA--C 1.537 0.461 0 CA-C-O 118.852 -0.594 . . . . 0.0 111.646 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.48 165.77 16.02 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.51 1.05 . . . . 0.0 111.958 173.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -133.55 -62.64 0.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 108.363 169.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 79.1 mtp85 -61.59 -38.08 86.25 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -88.86 -20.91 24.01 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 169.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.3 t -63.83 -42.17 97.68 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.159 0.891 . . . . 0.0 111.389 173.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -50.03 -42.01 48.6 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.479 1.112 . . . . 0.0 112.769 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.67 -30.39 70.7 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.672 1.189 . . . . 0.0 112.59 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -73.17 -48.47 35.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.937 0.895 . . . . 0.0 111.742 171.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.436 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.9 m -60.68 -31.5 70.75 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -62.43 -17.78 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.746 1.218 . . . . 0.0 114.162 175.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.3 p -57.53 -24.7 57.52 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.82 1.191 . . . . 0.0 114.03 170.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 77.7 mt -124.09 16.5 9.21 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.52 1.928 . . . . 0.0 112.044 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.49 25.6 70.21 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.362 0.982 . . . . 0.0 114.801 -177.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 27.4 mt -86.65 169.23 12.89 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.308 1.443 . . . . 0.0 111.763 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -98.88 140.77 32.55 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.924 2.49 . . . . 0.0 108.412 168.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.08 136.57 12.76 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.424 1.011 . . . . 0.0 113.654 177.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -141.78 138.99 32.67 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.925 1.69 . . . . 0.0 112.277 177.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -77.36 133.86 38.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.709 0.804 . . . . 0.0 112.521 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.4 mm -86.35 -37.73 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.827 0.851 . . . . 0.0 112.011 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 170.55 -53.13 0.19 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.716 1.151 . . . . 0.0 112.829 175.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -123.24 -3.31 8.48 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.416 1.886 . . . . 0.0 112.921 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -150.04 144.63 25.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.322 1.849 . . . . 0.0 111.099 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.9 t -91.34 145.95 24.22 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.014 0.925 . . . . 0.0 113.439 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.5 tptt -128.78 132.36 47.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.304 2.642 . . . . 0.0 109.596 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -83.1 157.61 22.76 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.676 0.79 . . . . 0.0 113.094 176.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.1 m -149.9 147.59 22.9 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 125.839 1.655 . . . . 0.0 111.034 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -90.16 25.62 0.55 Allowed 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.765 2.976 . . . . 0.0 115.205 -169.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 . . . . . 0 C--O 1.253 1.253 0 CA-C-O 116.999 -1.477 . . . . 0.0 113.846 -179.009 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.865 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -129.28 164.38 23.62 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.064 1.746 . . . . 0.0 110.662 169.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.6 tp -136.06 -61.34 0.71 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.152 0.981 . . . . 0.0 111.187 173.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.6 ttm-85 -61.18 -42.04 97.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.759 0.824 . . . . 0.0 112.26 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 tpp180 -68.42 -44.71 74.41 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.618 1.567 . . . . 0.0 111.866 168.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -55.36 -40.26 71.06 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.815 0.846 . . . . 0.0 112.377 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -61.26 -36.82 81.06 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.694 -1.254 . . . . 0.0 114.06 173.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 71.3 mt -71.03 -36.12 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.606 0.762 . . . . 0.0 111.846 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.3 m -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.465 1.106 . . . . 0.0 113.124 173.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.8 m -82.44 -12.53 57.8 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.0 mtm180 -53.73 -23.56 12.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.803 0.841 . . . . 0.0 112.655 167.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 99.0 p -41.85 -37.06 1.18 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.851 2.06 . . . . 0.0 114.915 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -133.35 19.07 3.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.708 2.003 . . . . 0.0 111.491 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.21 16.87 77.1 Favored Glycine 0 CA--C 1.537 1.435 0 C-N-CA 125.204 1.383 . . . . 0.0 115.178 -178.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.5 mt -94.43 166.93 11.82 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.653 1.581 . . . . 0.0 112.939 -170.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 mt -90.02 160.75 16.19 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.793 -1.094 . . . . 0.0 108.96 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -114.57 144.13 18.26 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.391 0.995 . . . . 0.0 112.701 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -140.99 151.76 44.38 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.226 1.81 . . . . 0.0 110.892 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 t -91.24 113.82 26.18 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 168.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.0 mt -129.7 104.77 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -174.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.49 54.85 17.43 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.124 0.868 . . . . 0.0 113.122 -175.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 60.37 18.42 8.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.962 1.705 . . . . 0.0 114.92 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -144.37 143.42 30.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.879 1.672 . . . . 0.0 112.409 176.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.9 t -70.67 137.7 50.04 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.807 1.243 . . . . 0.0 110.989 178.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -157.03 161.2 39.53 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.94 1.296 . . . . 0.0 111.764 168.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.5 m -94.33 159.92 14.91 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -169.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -147.79 148.92 31.89 Favored Pre-proline 0 N--CA 1.478 0.928 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -168.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -82.67 60.08 7.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.255 3.97 . . . . 0.0 112.648 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.1 m80 . . . . . 0 C--O 1.248 1.018 0 C-N-CA 127.735 2.414 . . . . 0.0 115.181 171.634 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -135.51 160.8 37.34 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.386 1.474 . . . . 0.0 110.095 168.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.6 tp -131.06 -67.87 0.69 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.91 0.884 . . . . 0.0 109.497 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -43.42 87.66 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.173 -0.918 . . . . 0.0 113.263 177.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -70.8 -40.61 72.42 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 118.863 0.756 . . . . 0.0 112.364 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.99 -44.35 87.12 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 117.695 0.225 . . . . 0.0 110.964 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -57.75 -33.61 68.66 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.982 1.313 . . . . 0.0 114.388 176.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 93.8 mt -70.92 -45.27 64.52 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.163 0.892 . . . . 0.0 111.497 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -62.17 -37.09 83.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.821 0.448 . . . . 0.0 111.632 171.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 76.4 m -67.26 -32.38 73.36 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 172.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -61.67 -25.87 67.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.817 -1.177 . . . . 0.0 112.42 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 m -61.85 -15.62 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 174.064 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -120.18 8.22 10.89 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 112.038 173.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.16 36.82 90.76 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.997 1.284 . . . . 0.0 113.755 -173.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 17.4 mt -109.24 159.93 16.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.663 1.185 . . . . 0.0 112.231 -177.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -89.77 150.12 22.42 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.864 2.065 . . . . 0.0 108.314 167.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.12 130.37 8.36 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 119.233 0.924 . . . . 0.0 111.763 174.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -134.67 147.2 50.08 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.786 1.634 . . . . 0.0 111.893 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.8 t -85.89 132.74 34.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 122.983 0.513 . . . . 0.0 111.2 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.3 pt -134.2 1.71 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -168.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.18 45.01 0.02 OUTLIER Glycine 0 N--CA 1.473 1.146 0 CA-C-N 119.484 1.038 . . . . 0.0 114.404 -173.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 62.02 25.11 15.03 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.008 1.323 . . . . 0.0 112.298 -169.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -158.32 147.56 19.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 128.202 2.601 . . . . 0.0 109.483 178.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -101.56 142.49 32.85 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 124.533 1.133 . . . . 0.0 111.813 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -127.85 134.17 49.4 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.821 1.248 . . . . 0.0 110.266 172.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.37 156.6 39.1 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 174.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.2 m -151.57 146.47 18.88 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 125.102 1.361 . . . . 0.0 111.646 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -81.08 62.68 8.6 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.867 3.045 . . . . 0.0 111.411 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.0 m80 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 127.94 2.496 . . . . 0.0 114.213 179.67 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.535 0.381 0 CA-C-O 119.807 -0.14 . . . . 0.0 111.316 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -92.35 166.51 12.54 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.737 -0.602 . . . . 0.0 109.938 167.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -130.38 -68.46 0.69 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 118.498 -0.763 . . . . 0.0 109.932 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -63.83 -47.3 81.33 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.934 1.243 . . . . 0.0 112.296 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -63.54 -38.2 90.21 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.563 0.62 . . . . 0.0 111.229 174.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.5 t -59.06 -46.01 89.33 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 172.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.61 -38.64 78.44 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.679 -1.263 . . . . 0.0 112.343 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.4 mt -71.72 -29.91 65.06 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -71.32 -39.53 71.33 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.901 0.881 . . . . 0.0 111.621 172.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 72.9 m -69.98 -27.98 65.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.709 1.204 . . . . 0.0 112.606 173.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 48.8 ttp85 -54.31 -32.48 56.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.925 1.29 . . . . 0.0 112.191 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.6 m -64.28 -7.19 8.58 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.0 mt -127.64 19.77 6.69 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.507 1.503 . . . . 0.0 111.723 169.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.88 20.7 70.8 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.203 0.906 . . . . 0.0 114.169 -175.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 31.4 mt -99.55 158.62 15.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.92 1.688 . . . . 0.0 111.662 -176.231 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -97.66 155.72 16.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.232 2.213 . . . . 0.0 109.157 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.53 125.61 6.77 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 124.231 0.92 . . . . 0.0 113.379 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -119.46 117.79 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.834 1.654 . . . . 0.0 111.129 179.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.0 t -73.25 122.03 21.3 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.804 -0.56 . . . . 0.0 110.428 172.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -87.33 -35.48 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 0.0 112.407 -174.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.79 -32.91 0.13 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.593 1.092 . . . . 0.0 114.925 173.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -138.32 -19.53 1.1 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.329 2.252 . . . . 0.0 111.908 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -134.64 148.49 50.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.226 1.811 . . . . 0.0 111.423 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -101.03 143.31 31.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.787 1.235 . . . . 0.0 112.93 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -119.87 141.77 49.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 127.223 2.209 . . . . 0.0 110.583 -175.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -91.14 152.31 20.63 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 171.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 m -153.65 153.89 29.57 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.501 1.52 . . . . 0.0 111.202 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.58 -17.8 26.17 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 121.832 1.688 . . . . 0.0 112.089 169.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 . . . . . 0 C--O 1.248 0.98 0 C-N-CA 127.064 2.146 . . . . 0.0 114.912 -174.837 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.1 t . . . . . 0 CA--C 1.543 0.688 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -93.33 159.64 15.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.256 1.022 . . . . 0.0 109.811 168.173 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -137.49 -65.24 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.341 0.656 . . . . 0.0 110.428 172.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.78 -23.78 66.42 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 177.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -89.1 -41.21 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.054 1.742 . . . . 0.0 111.99 169.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.3 t -58.93 -42.19 89.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.233 1.013 . . . . 0.0 112.159 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -56.95 -32.43 66.0 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.993 1.317 . . . . 0.0 114.111 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.0 mt -71.72 -40.27 69.57 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.632 -0.667 . . . . 0.0 111.732 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.5 t -73.83 -30.81 62.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.0 m -63.27 -36.68 84.48 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.088 -1.007 . . . . 0.0 113.13 172.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -59.07 -30.96 68.45 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.228 -0.92 . . . . 0.0 112.982 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -66.74 -14.3 62.4 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -114.79 6.62 15.58 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.53 1.532 . . . . 0.0 112.146 170.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.04 36.55 40.65 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.285 1.422 . . . . 0.0 114.609 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -123.34 160.78 26.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.595 1.558 . . . . 0.0 112.104 -169.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.6 mt -86.03 152.9 22.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.847 0.859 . . . . 0.0 108.728 165.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.56 128.94 9.71 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.855 0.741 . . . . 0.0 111.36 170.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -142.37 134.18 27.01 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.536 1.534 . . . . 0.0 111.653 -176.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 12.2 t -75.06 151.75 38.66 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -176.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.5 mt -97.98 -44.56 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.481 1.912 . . . . 0.0 109.689 169.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 168.69 -56.65 0.21 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.095 1.807 . . . . 0.0 110.905 177.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -126.71 11.12 7.22 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.371 1.468 . . . . 0.0 113.313 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -137.47 150.13 47.35 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 128.06 2.544 . . . . 0.0 109.887 168.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 39.2 t -105.38 147.28 28.38 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.778 0.831 . . . . 0.0 111.061 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -128.91 140.36 51.71 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.062 1.745 . . . . 0.0 111.038 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.2 m -88.86 146.79 24.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.246 0.618 . . . . 0.0 112.205 169.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.9 m -141.42 143.51 30.35 Favored Pre-proline 0 N--CA 1.482 1.127 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -84.29 57.3 5.21 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.582 3.521 . . . . 0.0 112.636 179.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 . . . . . 0 C--O 1.254 1.334 0 C-N-CA 127.833 2.453 . . . . 0.0 115.204 171.27 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.0 t . . . . . 0 CA--C 1.551 0.997 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -68.51 159.28 32.1 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.442 -0.786 . . . . 0.0 109.332 168.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -127.06 -76.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.202 1.401 . . . . 0.0 109.128 171.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -64.71 -33.3 75.63 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 117.916 -1.04 . . . . 0.0 112.573 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -77.13 -33.52 56.77 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.151 0.981 . . . . 0.0 112.707 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.3 t -61.87 -42.89 99.6 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.844 0.747 . . . . 0.0 111.675 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -54.76 -32.06 59.46 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.229 1.012 . . . . 0.0 113.485 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.4 mt -69.71 -30.55 68.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.046 0.939 . . . . 0.0 112.88 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 72.2 m -75.11 -41.68 58.07 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.623 0.769 . . . . 0.0 110.866 169.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.48 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.8 m -65.5 -23.43 66.89 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.514 1.125 . . . . 0.0 113.682 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -51.21 -28.13 10.65 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.647 1.979 . . . . 0.0 113.087 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.9 t -51.33 -34.71 34.81 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.663 1.585 . . . . 0.0 113.586 175.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.1 mt -122.18 19.59 10.69 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.105 1.362 . . . . 0.0 112.646 -177.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.2 24.67 74.74 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.246 0.926 . . . . 0.0 114.088 -178.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 16.5 mt -102.02 159.58 15.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.449 1.5 . . . . 0.0 112.101 -175.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.7 mt -93.5 173.4 7.72 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 164.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -132.29 139.0 10.57 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -139.54 137.38 35.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.397 1.079 . . . . 0.0 110.215 -174.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.0 t -84.17 142.55 30.25 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 176.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.0 mt -142.72 117.52 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.782 1.633 . . . . 0.0 107.78 173.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.77 44.97 96.52 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.683 -0.635 . . . . 0.0 114.061 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 68.49 28.91 5.84 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -148.89 146.75 28.05 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.092 -1.63 . . . . 0.0 111.583 168.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -89.03 153.19 21.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 174.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -147.42 144.49 28.69 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.427 1.891 . . . . 0.0 110.362 172.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.6 m -83.85 153.43 24.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.75 143.35 14.01 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.45 1.5 . . . . 0.0 111.911 -177.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.76 -21.22 6.11 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.549 2.833 . . . . 0.0 114.52 -169.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 126.439 1.896 . . . . 0.0 114.026 -169.758 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.3 t . . . . . 0 CA--C 1.551 1.015 0 CA-C-O 121.732 0.777 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -73.31 157.15 37.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.122 -0.986 . . . . 0.0 109.274 169.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -127.14 -72.09 0.65 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 117.879 -1.058 . . . . 0.0 110.988 171.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -62.01 -42.0 98.68 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 121.012 1.733 . . . . 0.0 112.922 173.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.3 mtt-85 -66.01 -35.95 81.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 118.757 0.708 . . . . 0.0 111.034 175.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.85 -42.42 97.57 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.103 0.961 . . . . 0.0 112.157 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.451 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 88.2 mt-10 -59.48 -29.83 68.11 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.927 -1.108 . . . . 0.0 112.909 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -72.52 -42.12 65.12 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.044 0.838 . . . . 0.0 112.595 170.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 m -62.28 -39.54 93.26 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.429 0.692 . . . . 0.0 111.637 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.0 m -70.73 -30.32 66.82 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.462 1.505 . . . . 0.0 113.405 175.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -57.0 -27.03 61.23 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.916 -1.115 . . . . 0.0 112.398 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.67 -17.84 50.07 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 175.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 98.8 mt -117.93 9.08 12.73 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.608 1.095 . . . . 0.0 112.914 170.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.13 18.39 74.62 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.73 1.157 . . . . 0.0 114.093 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 34.9 mt -95.06 176.51 6.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.06 1.744 . . . . 0.0 111.307 -178.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.03 168.76 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.691 1.996 . . . . 0.0 108.076 165.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.451 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -116.62 149.22 18.81 Favored Glycine 0 N--CA 1.471 1.016 0 C-N-CA 124.165 0.888 . . . . 0.0 114.178 -172.146 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -138.38 133.95 33.54 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.297 1.839 . . . . 0.0 109.464 170.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.4 t -75.25 142.46 43.35 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.307 -0.871 . . . . 0.0 111.228 172.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.4 mm -93.86 -30.27 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.629 1.172 . . . . 0.0 111.689 175.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 162.08 -39.7 0.38 Allowed Glycine 0 N--CA 1.472 1.084 0 C-N-CA 125.709 1.624 . . . . 0.0 114.112 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -124.61 -10.21 7.35 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.398 1.479 . . . . 0.0 112.338 174.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -148.92 154.25 39.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.524 1.93 . . . . 0.0 110.9 -176.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -96.87 152.32 18.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.027 0.931 . . . . 0.0 113.056 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -130.59 143.78 50.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.537 1.535 . . . . 0.0 110.349 169.264 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -84.07 158.82 21.3 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 m -144.81 139.96 15.86 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 126.517 1.927 . . . . 0.0 110.739 -175.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -92.76 -24.22 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.741 2.961 . . . . 0.0 116.656 -168.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 C--O 1.253 1.282 0 C-N-CA 126.995 2.118 . . . . 0.0 113.201 -168.834 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.552 1.021 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -126.98 174.33 8.94 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.056 1.343 . . . . 0.0 111.038 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.73 -73.57 0.43 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.31 1.044 . . . . 0.0 110.391 168.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.3 tpp85 -57.62 -45.74 85.01 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.365 1.438 . . . . 0.0 112.051 175.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.78 -28.42 67.59 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.382 -0.823 . . . . 0.0 113.037 176.224 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.4 t -67.95 -43.94 77.91 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.616 0.766 . . . . 0.0 111.586 169.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.37 -39.78 88.45 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.65 -1.281 . . . . 0.0 113.339 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -40.98 91.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.18 0.592 . . . . 0.0 111.69 175.122 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.9 t -63.43 -39.14 93.69 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 173.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 90.3 m -69.0 -12.21 61.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.035 1.334 . . . . 0.0 114.597 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -54.32 -26.48 29.8 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 121.162 -0.961 . . . . 0.0 112.532 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.5 t -54.97 -38.32 67.64 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -116.72 20.01 14.21 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.364 1.465 . . . . 0.0 113.579 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.52 25.82 73.77 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 120.92 -1.113 . . . . 0.0 115.029 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.8 mt -90.18 170.85 9.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.504 1.521 . . . . 0.0 111.353 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 mt -113.11 152.63 29.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.255 1.422 . . . . 0.0 110.037 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.41 131.07 9.93 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.235 0.921 . . . . 0.0 113.682 -172.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -131.25 141.04 49.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.022 1.329 . . . . 0.0 111.86 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.57 125.82 32.18 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.346 1.058 . . . . 0.0 111.911 -177.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -75.44 -47.25 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.626 1.17 . . . . 0.0 111.19 -177.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.44 -34.54 0.12 Allowed Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.613 1.578 . . . . 0.0 113.461 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -120.86 -26.02 5.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.629 1.972 . . . . 0.0 112.549 171.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -140.2 152.36 45.93 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.294 1.838 . . . . 0.0 111.983 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.1 t -113.99 134.98 54.49 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.679 1.191 . . . . 0.0 112.853 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -138.8 159.06 43.03 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 0.0 112.604 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -80.49 162.69 24.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -171.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -143.47 142.34 20.95 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.48 1.512 . . . . 0.0 112.318 178.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -81.15 -12.22 11.83 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.054 3.169 . . . . 0.0 115.076 -174.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 . . . . . 0 C--O 1.258 1.519 0 CA-C-O 116.71 -1.614 . . . . 0.0 113.446 176.602 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 118.078 -0.963 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -144.61 155.12 43.47 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.832 0.853 . . . . 0.0 112.112 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.0 m -78.91 70.33 5.23 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.191 0.996 . . . . 0.0 109.097 166.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.86 3.26 10.4 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -171.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp 37.33 -67.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.442 1 C-N-CA 135.624 5.569 . . . . 0.0 113.905 172.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 mtm105 -57.17 -49.13 76.93 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.68 1.592 . . . . 0.0 111.384 171.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -81.61 -29.49 33.26 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.432 1.093 . . . . 0.0 112.19 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.2 t -57.33 -49.37 76.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 122.948 0.499 . . . . 0.0 111.438 175.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.12 -47.23 75.29 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.466 1.506 . . . . 0.0 112.185 176.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.1 mt -66.6 -32.66 74.13 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -64.1 -47.12 81.25 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 122.41 0.284 . . . . 0.0 110.953 170.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.9 m -63.54 -23.5 67.42 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -60.76 -16.72 43.28 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.628 -1.295 . . . . 0.0 113.426 171.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.8 p -51.35 -33.84 31.28 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.384 0.993 . . . . 0.0 112.767 169.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.4 mt -113.01 11.15 18.93 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.757 1.223 . . . . 0.0 112.365 173.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 22.81 72.97 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.292 1.425 . . . . 0.0 113.943 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.3 mt -100.76 161.61 13.48 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.405 1.082 . . . . 0.0 113.043 -170.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.6 mt -79.54 143.4 34.86 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.716 1.606 . . . . 0.0 108.803 166.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.02 130.25 9.68 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 124.961 1.267 . . . . 0.0 112.533 178.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -138.38 156.66 47.39 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.18 1.392 . . . . 0.0 112.636 -172.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.14 137.02 32.7 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.449 1.1 . . . . 0.0 112.431 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 9.1 pt -135.31 44.53 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.699 1.199 . . . . 0.0 113.36 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 91.51 0.52 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.025 1.297 . . . . 0.0 110.827 -176.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 65.76 -6.89 0.39 Allowed 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 127.637 2.375 . . . . 0.0 117.097 175.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -133.09 142.73 48.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.076 1.35 . . . . 0.0 111.367 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.41 134.7 36.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.285 1.434 . . . . 0.0 111.386 172.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -144.21 135.17 25.24 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.78 0.832 . . . . 0.0 111.318 170.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -76.64 167.23 22.19 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.478 1.111 . . . . 0.0 113.09 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.4 m -141.55 142.66 26.85 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 112.428 -176.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.38 -4.5 15.52 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 124.393 3.395 . . . . 0.0 116.587 -169.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 32.0 m80 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 128.592 2.757 . . . . 0.0 116.825 -173.546 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -68.16 174.44 3.9 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.041 1.336 . . . . 0.0 113.644 -177.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 m -70.12 48.75 0.1 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.207 1.403 . . . . 0.0 114.69 177.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -51.89 -48.62 64.01 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 123.47 1.605 . . . . 0.0 113.898 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? 62.8 -56.53 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 1 C-N-CA 133.45 4.7 . . . . 0.0 111.61 -173.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.32 -54.36 34.23 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.214 1.006 . . . . 0.0 112.277 -176.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -74.51 -30.87 61.97 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.84 172.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.5 t -58.45 -40.85 83.73 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.958 0.903 . . . . 0.0 112.886 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.62 -35.22 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.1 mt -59.44 -38.37 80.53 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.556 0.616 . . . . 0.0 112.128 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 m -79.75 -18.77 50.32 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.282 1.433 . . . . 0.0 113.793 177.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 72.3 m -85.42 -34.67 21.65 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.331 1.053 . . . . 0.0 112.892 176.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.4 mtp180 -51.91 -32.42 32.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.493 1.117 . . . . 0.0 112.659 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -61.61 -10.3 7.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.099 2.16 . . . . 0.0 116.289 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -126.34 7.0 7.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.726 1.21 . . . . 0.0 112.997 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.03 44.51 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.306 0.955 . . . . 0.0 114.325 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.45 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 17.7 mt -115.43 163.6 15.49 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.66 1.23 . . . . 0.0 112.799 -171.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.7 mt -108.81 155.84 20.32 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 126.091 1.756 . . . . 0.0 109.16 167.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -89.19 142.03 16.59 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 123.623 0.63 . . . . 0.0 111.652 172.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -137.53 134.13 35.33 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.087 1.355 . . . . 0.0 111.468 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -74.7 139.18 43.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.224 1.41 . . . . 0.0 111.681 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.3 pt -138.57 57.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 126.74 2.016 . . . . 0.0 111.224 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.11 91.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.731 0 C-N-CA 125.415 1.483 . . . . 0.0 112.4 177.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 64.19 2.88 1.58 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.229 1.812 . . . . 0.0 115.356 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -140.2 141.69 35.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.784 1.634 . . . . 0.0 111.917 -178.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.9 t -112.7 143.9 43.12 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.586 1.154 . . . . 0.0 112.395 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -152.2 155.71 38.31 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.207 2.203 . . . . 0.0 110.169 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.6 m -83.73 159.25 21.52 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -173.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.8 m -145.87 144.34 21.87 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 125.269 1.428 . . . . 0.0 112.376 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -82.09 -4.52 11.91 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.092 3.194 . . . . 0.0 113.356 176.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 125.548 1.539 . . . . 0.0 113.974 -174.495 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 110.595 -0.15 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -123.33 170.42 10.33 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.647 1.179 . . . . 0.0 111.622 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.4 m -72.87 117.44 14.58 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -66.78 -43.8 83.02 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 124.808 2.242 . . . . 0.0 113.075 173.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.4 tm? 62.34 -49.19 0.17 Allowed 'General case' 0 C--N 1.319 -0.73 1 C-N-CA 133.682 4.793 . . . . 0.0 113.532 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -73.39 -56.13 5.46 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.849 0.75 . . . . 0.0 110.842 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -60.74 -31.89 71.2 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.51 -0.744 . . . . 0.0 112.075 171.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.79 -52.32 66.2 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 168.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 89.6 mt-10 -60.16 -35.21 74.82 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.803 -1.185 . . . . 0.0 113.773 176.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.68 -46.63 78.33 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.922 0.889 . . . . 0.0 111.813 174.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -65.86 -41.57 91.48 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.043 -0.411 . . . . 0.0 111.707 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m -59.45 -29.07 67.53 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.271 -0.893 . . . . 0.0 113.307 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -61.11 -18.29 57.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 177.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -57.99 -27.65 63.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.148 1.34 . . . . 0.0 113.25 174.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -113.15 21.07 15.7 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.699 1.599 . . . . 0.0 111.731 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.44 -8.74 12.32 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.549 2.023 . . . . 0.0 116.143 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.41 161.13 31.23 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.25 1.82 . . . . 0.0 113.078 -169.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.2 mt -99.71 152.56 19.95 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.133 0.973 . . . . 0.0 109.416 165.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -99.32 141.69 15.65 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 124.84 1.21 . . . . 0.0 112.138 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 139.76 40.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.153 1.381 . . . . 0.0 110.127 172.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.4 t -75.62 128.37 35.1 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.86 0.864 . . . . 0.0 110.798 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -139.41 117.23 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.41 45.14 97.02 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 121.875 -0.516 . . . . 0.0 113.257 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 60.44 10.59 2.54 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -124.95 120.77 32.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.765 1.226 . . . . 0.0 110.606 170.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.4 t -74.85 132.28 41.39 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 174.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -126.43 153.76 44.59 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.085 1.754 . . . . 0.0 109.842 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.0 m -80.89 161.27 24.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.457 0.703 . . . . 0.0 111.324 170.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.78 138.23 32.66 Favored Pre-proline 0 N--CA 1.481 1.116 0 O-C-N 121.572 -0.705 . . . . 0.0 110.682 -178.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -72.05 -9.59 24.79 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 123.818 3.012 . . . . 0.0 115.07 -168.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.1 m80 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.486 1.914 . . . . 0.0 115.875 -175.696 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -137.67 -153.5 0.49 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.0 1.32 . . . . 0.0 112.674 -169.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.3 m -69.89 123.63 21.97 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.617 1.567 . . . . 0.0 113.323 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -66.74 -49.2 66.75 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 124.275 1.988 . . . . 0.0 112.052 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.9 tp 61.58 -51.1 0.13 Allowed 'General case' 0 C--N 1.32 -0.688 1 C-N-CA 133.157 4.583 . . . . 0.0 113.052 -171.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 71.3 mtm180 -73.84 -36.27 64.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -174.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -83.01 -36.54 24.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.039 1.736 . . . . 0.0 111.446 168.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.2 t -52.27 -45.73 65.54 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.071 0.548 . . . . 0.0 112.073 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.24 -39.38 72.46 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.155 0.982 . . . . 0.0 113.206 173.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.49 -39.17 77.81 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.014 0.926 . . . . 0.0 112.34 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -66.81 -39.21 87.63 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.436 0.694 . . . . 0.0 111.54 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 71.6 m -65.39 -34.63 78.76 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.961 0.904 . . . . 0.0 113.241 171.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -61.5 -25.66 67.41 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.162 0.985 . . . . 0.0 112.924 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.1 m -64.44 -10.94 28.46 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 172.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -126.63 4.6 6.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.468 1.907 . . . . 0.0 112.33 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.56 28.59 69.16 Favored Glycine 0 CA--C 1.532 1.15 0 O-C-N 121.318 -0.864 . . . . 0.0 114.24 -173.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 18.7 mt -109.45 167.95 9.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.427 1.491 . . . . 0.0 111.425 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 mt -112.0 142.47 44.38 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 108.914 168.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -105.43 136.32 13.11 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.606 1.098 . . . . 0.0 112.756 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -145.79 157.54 43.92 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.048 0.924 . . . . 0.0 112.533 170.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.73 123.29 28.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.7 0.8 . . . . 0.0 111.99 -177.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mm -88.6 60.2 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.447 1.499 . . . . 0.0 109.206 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.84 -54.51 2.99 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 126.242 1.877 . . . . 0.0 113.831 -170.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -153.75 11.26 0.43 Allowed 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -174.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -136.9 128.86 29.29 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.586 1.555 . . . . 0.0 107.953 168.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.8 t -81.71 150.73 27.85 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.171 -0.956 . . . . 0.0 111.772 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -150.26 135.52 17.96 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.002 0.521 . . . . 0.0 112.05 -173.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.3 m -82.11 155.41 25.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.861 0.864 . . . . 0.0 112.714 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.6 m -148.23 143.41 17.49 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 124.876 1.27 . . . . 0.0 111.365 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -77.66 -9.01 17.17 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.769 2.98 . . . . 0.0 115.333 -171.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.0 m80 . . . . . 0 C--O 1.249 1.074 0 C-N-CA 127.151 2.18 . . . . 0.0 113.999 -173.743 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -142.38 166.35 24.91 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.83 1.652 . . . . 0.0 111.082 176.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.4 m -71.63 149.79 45.26 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -92.56 167.2 12.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.797 1.239 . . . . 0.0 108.493 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.93 -53.04 0.47 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.37 169.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -59.59 -56.82 17.05 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.124 0.875 . . . . 0.0 112.085 169.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -66.15 -37.96 86.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.688 1.131 . . . . 0.0 112.624 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.6 t -60.57 -49.4 77.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.027 0.931 . . . . 0.0 111.878 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -63.08 -40.68 98.37 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 117.641 -1.171 . . . . 0.0 112.299 176.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.73 -45.93 88.54 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.651 1.569 . . . . 0.0 111.731 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 68.6 m -64.47 -32.39 74.0 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.1 m -82.74 -47.51 11.88 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -62.09 -20.26 63.83 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.937 1.295 . . . . 0.0 112.057 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -62.59 -23.72 67.19 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 171.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.2 mt -110.06 14.18 23.03 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.619 1.568 . . . . 0.0 111.995 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.35 20.13 76.57 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.738 1.161 . . . . 0.0 114.383 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.2 mt -92.77 162.23 14.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.522 1.529 . . . . 0.0 111.317 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -92.93 141.17 28.71 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.135 0.974 . . . . 0.0 108.781 167.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.3 132.34 11.08 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 124.808 1.194 . . . . 0.0 111.922 177.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.7 154.89 34.96 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.208 1.003 . . . . 0.0 112.849 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.5 t -91.18 132.17 36.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.536 1.134 . . . . 0.0 112.082 -174.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -75.13 -37.25 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.759 0.823 . . . . 0.0 110.604 170.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 165.48 -38.07 0.27 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 126.113 1.816 . . . . 0.0 111.839 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -148.82 7.53 0.74 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.064 2.145 . . . . 0.0 113.278 169.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.62 132.65 52.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.409 1.883 . . . . 0.0 111.325 173.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.06 141.42 45.73 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.437 1.095 . . . . 0.0 111.97 172.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -131.03 141.35 50.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.095 2.158 . . . . 0.0 111.105 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.1 m -103.87 153.7 20.46 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.077 0.951 . . . . 0.0 112.003 169.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.9 m -148.4 144.5 18.7 Favored Pre-proline 0 N--CA 1.484 1.229 0 C-N-CA 124.428 1.091 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -87.88 -14.57 3.5 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.722 2.948 . . . . 0.0 114.187 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--O 1.252 1.212 0 C-N-CA 126.562 1.945 . . . . 0.0 116.192 -168.562 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -145.15 145.32 31.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.286 1.435 . . . . 0.0 112.297 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -70.13 151.13 45.79 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -93.83 178.93 5.51 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 162.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.78 -66.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.5 tpp85 -59.46 -49.05 79.3 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.067 0.849 . . . . 0.0 112.287 177.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -62.13 -35.21 78.06 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.057 0.943 . . . . 0.0 112.299 177.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -71.09 -50.54 32.61 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.221 1.408 . . . . 0.0 111.321 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.79 -37.19 75.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.864 1.666 . . . . 0.0 112.54 176.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.09 -40.34 82.68 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.775 1.23 . . . . 0.0 112.811 174.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.8 t -58.42 -46.77 85.82 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 169.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 78.2 m -68.97 -31.43 70.29 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -56.61 -33.73 66.54 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.801 1.24 . . . . 0.0 111.731 174.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.5 m -68.9 -3.15 11.59 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.8 mt -125.18 7.01 7.84 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 120.127 1.331 . . . . 0.0 111.769 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.9 27.76 71.73 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.799 1.19 . . . . 0.0 113.956 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 16.2 mt -110.15 161.61 15.4 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.049 1.74 . . . . 0.0 112.076 -178.024 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -96.96 148.91 22.49 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.579 1.151 . . . . 0.0 108.9 166.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -96.48 140.95 15.34 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.189 1.376 . . . . 0.0 112.126 174.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -136.12 134.56 38.46 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.961 1.704 . . . . 0.0 111.06 -178.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.5 t -76.89 137.88 39.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.188 0.595 . . . . 0.0 112.306 173.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -121.72 75.74 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.493 1.517 . . . . 0.0 108.853 172.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.35 -55.11 2.81 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.306 1.908 . . . . 0.0 114.526 175.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -146.91 -0.83 0.7 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.932 1.293 . . . . 0.0 114.326 -174.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -142.86 134.33 26.33 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.302 1.041 . . . . 0.0 110.776 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.8 t -97.13 138.77 34.13 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.007 0.923 . . . . 0.0 112.29 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -137.66 162.85 32.74 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.388 1.875 . . . . 0.0 112.066 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.5 m -80.32 161.83 24.86 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.64 143.43 32.41 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 123.404 0.682 . . . . 0.0 112.064 -176.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.63 -1.79 11.79 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.883 3.056 . . . . 0.0 114.529 -172.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.9 m80 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 125.158 1.383 . . . . 0.0 113.696 -169.525 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -72.45 88.46 1.21 Allowed 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.853 -1.154 . . . . 0.0 111.614 178.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t -81.43 54.51 2.35 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.801 2.04 . . . . 0.0 111.831 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -72.68 163.71 27.65 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.873 -1.142 . . . . 0.0 110.445 169.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -134.29 -71.33 0.5 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.254 1.021 . . . . 0.0 109.432 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 -55.17 -38.63 68.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.835 1.254 . . . . 0.0 112.919 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -86.75 -30.12 21.84 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.26 1.424 . . . . 0.0 113.817 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.6 t -62.78 -37.32 86.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.79 0.436 . . . . 0.0 111.424 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -52.1 -32.13 33.72 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.1 mt -78.25 -26.99 47.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.712 1.205 . . . . 0.0 112.337 -178.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.1 m -74.86 -41.94 58.87 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.546 0.738 . . . . 0.0 110.581 168.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.3 m -68.51 -23.46 64.55 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.399 1.079 . . . . 0.0 113.195 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -52.5 -26.11 12.1 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.311 1.844 . . . . 0.0 113.536 174.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 t -53.86 -34.33 59.01 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.3 mt -119.91 21.98 11.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.722 1.609 . . . . 0.0 112.157 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.09 23.95 71.56 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 123.972 0.796 . . . . 0.0 114.557 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 18.0 mt -94.01 163.93 13.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.131 1.372 . . . . 0.0 110.702 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -105.69 159.98 15.57 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.389 1.076 . . . . 0.0 108.398 166.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.57 138.47 13.94 Favored Glycine 0 CA--C 1.528 0.858 0 CA-C-O 118.622 -1.099 . . . . 0.0 111.671 177.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -137.29 135.58 37.25 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.827 2.051 . . . . 0.0 109.302 175.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.59 136.02 34.92 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.153 -0.967 . . . . 0.0 111.287 173.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.6 mt -120.72 100.46 9.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 124.883 1.273 . . . . 0.0 108.58 175.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 -66.98 2.4 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 127.222 2.344 . . . . 0.0 112.112 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -159.2 16.97 0.17 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.331 1.452 . . . . 0.0 112.974 -170.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -149.28 133.54 17.38 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.918 1.287 . . . . 0.0 110.315 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -84.04 133.28 34.67 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -118.35 156.67 28.53 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 127.994 2.518 . . . . 0.0 109.787 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -95.29 156.67 16.22 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.478 0.711 . . . . 0.0 112.442 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.2 m -142.0 140.89 20.33 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -85.97 70.55 4.58 Favored 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.755 4.304 . . . . 0.0 110.939 176.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.6 p80 . . . . . 0 C--O 1.25 1.111 0 C-N-CA 129.51 3.124 . . . . 0.0 117.491 -173.822 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 110.213 -0.291 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -142.26 131.14 22.94 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.736 0.814 . . . . 0.0 112.176 178.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 56.2 m -76.29 115.85 16.41 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.056 1.742 . . . . 0.0 113.457 -178.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -76.6 172.75 12.51 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.457 -0.777 . . . . 0.0 109.387 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.17 -59.51 1.04 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.423 168.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -62.29 -51.71 66.59 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.877 1.217 . . . . 0.0 112.07 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -65.0 -28.98 69.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.4 0.68 . . . . 0.0 112.068 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.3 t -68.06 -49.36 61.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 117.878 0.308 . . . . 0.0 111.114 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.85 -37.88 83.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.124 1.369 . . . . 0.0 112.545 174.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.07 -39.78 94.82 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.962 0.905 . . . . 0.0 112.471 172.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.9 m -68.95 -46.53 67.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.09 0.556 . . . . 0.0 111.583 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 85.5 m -62.72 -19.2 63.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.729 1.212 . . . . 0.0 114.051 176.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -55.56 -21.81 18.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.385 1.074 . . . . 0.0 112.522 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -56.12 -22.34 27.73 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.724 1.21 . . . . 0.0 114.003 173.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.9 mt -120.4 10.73 11.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.537 1.535 . . . . 0.0 112.881 170.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.88 24.87 76.65 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 124.674 1.131 . . . . 0.0 113.839 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 31.7 mt -97.84 168.59 10.22 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.985 1.314 . . . . 0.0 111.55 -177.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -106.24 171.95 7.07 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 164.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.72 138.45 9.95 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 123.902 0.763 . . . . 0.0 113.213 -168.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -142.16 144.9 33.66 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.744 1.617 . . . . 0.0 111.661 -173.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.64 157.05 34.23 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.651 1.58 . . . . 0.0 114.222 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 15.5 mt -140.35 78.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 128.168 2.587 . . . . 0.0 107.243 168.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -56.08 0.42 Allowed Glycine 0 CA--C 1.536 1.397 0 C-N-CA 128.442 2.925 . . . . 0.0 115.086 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -145.3 -8.28 0.6 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.716 2.006 . . . . 0.0 114.638 -176.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -111.76 129.34 56.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.331 1.452 . . . . 0.0 109.897 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.9 t -99.42 127.37 45.45 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.507 1.049 . . . . 0.0 111.922 174.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -131.2 145.08 51.79 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.078 1.751 . . . . 0.0 112.23 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.6 m -84.33 159.79 20.83 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.53 142.86 24.41 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.223 1.009 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -77.89 -4.1 14.14 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 124.667 3.578 . . . . 0.0 113.193 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.9 m80 . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.236 1.815 . . . . 0.0 114.097 -175.664 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.796 0 N-CA-C 111.275 0.102 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -46.41 130.05 10.77 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.942 2.097 . . . . 0.0 115.12 -173.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.3 t -88.62 122.12 31.72 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.243 1.017 . . . . 0.0 108.972 169.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -87.91 155.01 20.07 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.25 -0.907 . . . . 0.0 111.958 -174.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.61 -64.71 0.74 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.782 0.833 . . . . 0.0 109.439 174.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -59.78 -36.06 75.91 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -81.29 -35.1 31.48 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 119.306 0.957 . . . . 0.0 113.202 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.9 t -64.25 -42.83 96.33 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -56.21 -32.67 64.62 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 120.819 -1.175 . . . . 0.0 112.264 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 69.5 mt -73.69 -29.24 62.17 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.872 1.269 . . . . 0.0 113.435 175.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.2 t -69.92 -47.84 60.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.29 0.636 . . . . 0.0 110.578 169.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 76.6 m -59.62 -35.38 74.23 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.63 -0.669 . . . . 0.0 112.668 177.161 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -56.12 -23.18 32.7 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.149 1.38 . . . . 0.0 113.546 174.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.4 t -59.79 -28.25 67.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.302 1.041 . . . . 0.0 113.581 172.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -113.44 18.75 17.48 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.035 1.734 . . . . 0.0 111.089 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.67 5.52 24.54 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 126.995 2.236 . . . . 0.0 115.349 -173.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.443 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 32.8 mt -75.31 165.63 24.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.178 1.791 . . . . 0.0 113.042 -173.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 tp -98.57 160.43 14.28 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.814 2.046 . . . . 0.0 108.806 168.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -130.64 145.05 16.46 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-N 120.272 1.396 . . . . 0.0 114.658 -178.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.46 147.36 32.11 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 126.422 1.889 . . . . 0.0 112.063 175.19 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 t -81.85 120.01 24.65 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.278 0.49 . . . . 0.0 112.065 176.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -89.07 -63.64 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.579 -0.701 . . . . 0.0 111.449 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -151.52 73.83 0.27 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 125.236 1.398 . . . . 0.0 110.446 -178.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 61.18 22.06 12.42 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.954 1.701 . . . . 0.0 113.735 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.87 129.22 13.8 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 125.891 1.676 . . . . 0.0 110.381 169.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.2 t -76.01 129.2 36.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.795 1.238 . . . . 0.0 112.342 175.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -106.09 137.68 43.59 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.648 1.979 . . . . 0.0 109.489 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.0 m -87.34 147.23 25.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.974 0.416 . . . . 0.0 112.038 169.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.3 m -141.64 142.22 25.15 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 124.281 1.032 . . . . 0.0 112.775 -168.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.56 9.39 4.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.644 3.563 . . . . 0.0 114.504 -171.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.5 m80 . . . . . 0 C--O 1.25 1.085 0 C-N-CA 126.157 1.783 . . . . 0.0 114.23 179.305 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 119.962 -0.066 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -78.37 157.63 29.03 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.93 0.892 . . . . 0.0 111.495 171.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.8 t -60.91 130.13 44.91 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.19 0.596 . . . . 0.0 112.048 175.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -94.06 159.31 15.22 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.241 -0.912 . . . . 0.0 110.85 169.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -127.82 -66.13 0.88 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.873 1.269 . . . . 0.0 108.624 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -62.73 -37.64 87.35 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.697 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -80.74 -33.01 35.43 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.987 0.812 . . . . 0.0 112.353 171.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.1 t -61.45 -42.32 98.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.825 0.739 . . . . 0.0 112.328 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -57.57 -22.29 43.94 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.755 -1.216 . . . . 0.0 113.813 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.1 mt -63.84 -24.97 67.96 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.539 1.063 . . . . 0.0 113.545 175.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -82.5 -44.66 15.68 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.949 -0.469 . . . . 0.0 111.175 169.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 79.6 m -67.6 -43.93 79.33 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.9 -18.25 65.21 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.115 0.966 . . . . 0.0 113.169 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.3 t -65.28 -24.12 67.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.463 0.705 . . . . 0.0 112.564 171.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -107.81 12.9 26.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.914 1.686 . . . . 0.0 111.904 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.57 22.56 77.91 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 125.294 1.426 . . . . 0.0 114.761 -176.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.45 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 27.8 mt -96.61 171.56 8.46 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.228 1.411 . . . . 0.0 112.701 -174.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.8 tp -108.3 147.28 31.68 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.198 2.599 . . . . 0.0 108.685 168.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.89 130.2 10.15 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.445 1.022 . . . . 0.0 113.057 173.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -140.0 149.44 43.23 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.28 1.832 . . . . 0.0 111.751 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.5 m -78.95 116.53 19.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.735 0.814 . . . . 0.0 111.875 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 7.8 tt -83.53 -11.25 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 125.732 1.613 . . . . 0.0 114.646 -172.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 175.3 -48.89 0.13 Allowed Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.944 1.735 . . . . 0.0 111.579 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -154.99 14.57 0.4 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.655 1.982 . . . . 0.0 112.566 168.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -142.05 146.9 36.0 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.237 1.815 . . . . 0.0 111.386 -175.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.9 t -86.37 127.0 34.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.69 0.677 . . . . 0.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -132.37 150.19 52.21 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.855 0.862 . . . . 0.0 112.777 172.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -87.77 149.11 24.39 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -169.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 m -146.28 144.07 20.51 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.127 1.371 . . . . 0.0 112.777 -174.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -88.76 0.69 6.35 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.304 3.336 . . . . 0.0 115.914 -170.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.1 m80 . . . . . 0 C--O 1.256 1.404 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -171.706 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -70.96 -178.61 1.98 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.373 1.469 . . . . 0.0 113.032 -173.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.2 t -71.1 45.43 0.09 Allowed 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 126.242 1.817 . . . . 0.0 115.273 -172.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.07 171.27 14.41 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.472 -1.392 . . . . 0.0 112.578 174.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -139.69 -59.52 0.56 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.312 1.045 . . . . 0.0 109.929 169.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.53 -23.36 66.86 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -93.64 -36.24 12.46 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.353 1.061 . . . . 0.0 112.514 169.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -67.49 -37.38 82.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.658 0.783 . . . . 0.0 113.084 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.87 -31.89 65.28 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.996 -1.065 . . . . 0.0 112.235 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 mt -64.79 -42.13 95.28 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.359 1.064 . . . . 0.0 112.895 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.8 p -78.09 -35.41 49.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.988 1.315 . . . . 0.0 112.416 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.1 m -70.48 -44.8 66.96 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 172.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -65.13 -21.89 66.85 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.595 -1.315 . . . . 0.0 112.894 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.6 m -61.46 -19.04 61.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 169.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.7 mt -112.18 13.62 20.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.406 1.882 . . . . 0.0 112.492 175.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 24.76 67.62 Favored Glycine 0 CA--C 1.54 1.621 0 C-N-CA 124.151 0.881 . . . . 0.0 115.266 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.1 mt -111.13 -179.15 3.65 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.457 2.303 . . . . 0.0 111.748 -174.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.8 mt -107.42 163.42 13.06 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.539 1.535 . . . . 0.0 107.96 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.92 132.03 9.63 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.53 1.538 . . . . 0.0 111.824 174.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -145.04 139.68 27.59 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.739 1.615 . . . . 0.0 111.285 -175.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.8 t -76.75 138.36 39.88 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.393 -0.817 . . . . 0.0 112.297 175.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.9 mm -82.39 -57.34 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.329 1.452 . . . . 0.0 110.728 170.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.04 -41.02 0.04 OUTLIER Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.158 0.885 . . . . 0.0 113.797 178.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -132.06 0.97 3.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.498 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -140.08 154.13 46.96 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.396 2.278 . . . . 0.0 110.296 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.1 t -110.87 137.31 48.67 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.54 0.736 . . . . 0.0 111.823 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -141.15 163.51 32.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.971 1.708 . . . . 0.0 110.627 -170.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.9 m -101.11 158.34 16.09 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -168.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -149.52 147.3 22.69 Favored Pre-proline 0 N--CA 1.483 1.189 0 C-N-CA 124.1 0.96 . . . . 0.0 113.466 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -84.22 63.24 6.84 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 125.297 3.998 . . . . 0.0 112.265 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.0 m80 . . . . . 0 C--O 1.252 1.224 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 172.802 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.035 0 CA-C-O 118.985 -0.531 . . . . 0.0 112.137 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -149.64 145.22 26.63 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 125.932 1.693 . . . . 0.0 113.284 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.5 m -87.38 120.65 28.89 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.75 1.62 . . . . 0.0 113.867 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -78.36 174.57 11.12 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.431 -0.793 . . . . 0.0 110.938 167.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.8 tt -142.62 -63.76 0.42 Allowed 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.698 -0.626 . . . . 0.0 110.252 168.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -39.15 81.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.055 0.942 . . . . 0.0 112.025 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -78.71 -33.08 47.1 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.99 1.268 . . . . 0.0 112.837 172.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.1 t -67.49 -40.82 85.26 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.863 0.865 . . . . 0.0 112.441 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -60.23 -42.11 94.55 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.783 -1.198 . . . . 0.0 112.275 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.6 mt -66.89 -41.49 87.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.243 1.017 . . . . 0.0 112.074 174.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.8 t -63.25 -45.31 92.14 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.466 1.107 . . . . 0.0 112.199 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -70.2 -31.53 69.03 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -63.67 -24.04 67.62 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.936 -1.103 . . . . 0.0 112.414 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -66.55 1.57 1.66 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 170.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -128.16 4.14 5.82 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.657 1.983 . . . . 0.0 111.48 167.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.11 31.41 38.83 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 126.382 1.944 . . . . 0.0 114.402 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -121.68 159.79 25.83 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.907 1.353 . . . . 0.0 112.6 -170.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.4 tp -87.39 148.64 24.92 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.016 1.727 . . . . 0.0 109.341 168.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -108.36 128.59 9.17 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.584 1.088 . . . . 0.0 113.411 175.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -141.99 143.15 33.06 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 127.563 2.345 . . . . 0.0 112.147 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.6 t -72.55 146.85 46.46 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.374 1.069 . . . . 0.0 113.137 174.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.3 pt -123.16 10.36 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 125.436 1.494 . . . . 0.0 114.37 171.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.15 -58.42 0.51 Allowed Glycine 0 CA--C 1.53 0.984 0 C-N-CA 125.373 1.463 . . . . 0.0 112.157 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -142.09 -0.11 1.32 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.85 1.26 . . . . 0.0 113.298 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -125.33 135.35 52.37 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.891 1.677 . . . . 0.0 109.774 170.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.7 t -90.29 117.29 28.92 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.956 -0.465 . . . . 0.0 110.05 168.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -102.59 165.85 10.85 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.869 1.268 . . . . 0.0 112.02 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -102.54 148.44 25.53 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.5 m -150.75 152.94 33.05 Favored Pre-proline 0 N--CA 1.478 0.966 0 C-N-CA 124.971 1.308 . . . . 0.0 112.417 -173.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -77.19 68.42 7.41 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.704 3.602 . . . . 0.0 110.424 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.9 m80 . . . . . 0 C--O 1.248 1.014 0 C-N-CA 128.626 2.77 . . . . 0.0 114.072 169.793 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.8 0 CA-C-O 119.346 -0.359 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -126.28 141.78 51.78 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.389 1.475 . . . . 0.0 110.826 172.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.5 t -91.13 116.94 29.2 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.907 1.283 . . . . 0.0 111.646 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.48 165.77 16.02 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.51 1.05 . . . . 0.0 111.958 173.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -133.55 -62.64 0.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 108.363 169.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 79.1 mtp85 -61.59 -38.08 86.25 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -88.86 -20.91 24.01 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 169.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.3 t -63.83 -42.17 97.68 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.159 0.891 . . . . 0.0 111.389 173.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -50.03 -42.01 48.6 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.479 1.112 . . . . 0.0 112.769 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.67 -30.39 70.7 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.672 1.189 . . . . 0.0 112.59 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -73.17 -48.47 35.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.937 0.895 . . . . 0.0 111.742 171.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.436 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.9 m -60.68 -31.5 70.75 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -62.43 -17.78 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.746 1.218 . . . . 0.0 114.162 175.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.3 p -57.53 -24.7 57.52 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.82 1.191 . . . . 0.0 114.03 170.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 77.7 mt -124.09 16.5 9.21 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.52 1.928 . . . . 0.0 112.044 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.49 25.6 70.21 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.362 0.982 . . . . 0.0 114.801 -177.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 27.4 mt -86.65 169.23 12.89 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.308 1.443 . . . . 0.0 111.763 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -98.88 140.77 32.55 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.924 2.49 . . . . 0.0 108.412 168.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.08 136.57 12.76 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.424 1.011 . . . . 0.0 113.654 177.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -141.78 138.99 32.67 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.925 1.69 . . . . 0.0 112.277 177.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -77.36 133.86 38.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.709 0.804 . . . . 0.0 112.521 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.4 mm -86.35 -37.73 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.827 0.851 . . . . 0.0 112.011 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 170.55 -53.13 0.19 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.716 1.151 . . . . 0.0 112.829 175.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -123.24 -3.31 8.48 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.416 1.886 . . . . 0.0 112.921 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -150.04 144.63 25.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.322 1.849 . . . . 0.0 111.099 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.9 t -91.34 145.95 24.22 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.014 0.925 . . . . 0.0 113.439 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.5 tptt -128.78 132.36 47.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.304 2.642 . . . . 0.0 109.596 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -83.1 157.61 22.76 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.676 0.79 . . . . 0.0 113.094 176.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.1 m -149.9 147.59 22.9 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 125.839 1.655 . . . . 0.0 111.034 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -90.16 25.62 0.55 Allowed 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.765 2.976 . . . . 0.0 115.205 -169.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 . . . . . 0 C--O 1.253 1.253 0 CA-C-O 116.999 -1.477 . . . . 0.0 113.846 -179.009 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 120.729 0.299 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -87.51 36.55 0.75 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.195 1.398 . . . . 0.0 113.365 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -89.43 165.66 14.2 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.358 1.463 . . . . 0.0 114.294 -171.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -129.28 164.38 23.62 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.064 1.746 . . . . 0.0 110.662 169.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.6 tp -136.06 -61.34 0.71 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.152 0.981 . . . . 0.0 111.187 173.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.6 ttm-85 -61.18 -42.04 97.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.759 0.824 . . . . 0.0 112.26 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 tpp180 -68.42 -44.71 74.41 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.618 1.567 . . . . 0.0 111.866 168.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -55.36 -40.26 71.06 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.815 0.846 . . . . 0.0 112.377 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -61.26 -36.82 81.06 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.694 -1.254 . . . . 0.0 114.06 173.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 71.3 mt -71.03 -36.12 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.606 0.762 . . . . 0.0 111.846 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.3 m -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.465 1.106 . . . . 0.0 113.124 173.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.8 m -82.44 -12.53 57.8 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.0 mtm180 -53.73 -23.56 12.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.803 0.841 . . . . 0.0 112.655 167.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 99.0 p -41.85 -37.06 1.18 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.851 2.06 . . . . 0.0 114.915 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -133.35 19.07 3.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.708 2.003 . . . . 0.0 111.491 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.21 16.87 77.1 Favored Glycine 0 CA--C 1.537 1.435 0 C-N-CA 125.204 1.383 . . . . 0.0 115.178 -178.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.5 mt -94.43 166.93 11.82 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.653 1.581 . . . . 0.0 112.939 -170.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 mt -90.02 160.75 16.19 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.793 -1.094 . . . . 0.0 108.96 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -114.57 144.13 18.26 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.391 0.995 . . . . 0.0 112.701 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -140.99 151.76 44.38 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.226 1.81 . . . . 0.0 110.892 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 t -91.24 113.82 26.18 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 168.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.0 mt -129.7 104.77 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -174.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.49 54.85 17.43 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.124 0.868 . . . . 0.0 113.122 -175.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 60.37 18.42 8.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.962 1.705 . . . . 0.0 114.92 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -144.37 143.42 30.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.879 1.672 . . . . 0.0 112.409 176.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.9 t -70.67 137.7 50.04 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.807 1.243 . . . . 0.0 110.989 178.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -157.03 161.2 39.53 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.94 1.296 . . . . 0.0 111.764 168.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.5 m -94.33 159.92 14.91 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -169.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -147.79 148.92 31.89 Favored Pre-proline 0 N--CA 1.478 0.928 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -168.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -82.67 60.08 7.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.255 3.97 . . . . 0.0 112.648 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.1 m80 . . . . . 0 C--O 1.248 1.018 0 C-N-CA 127.735 2.414 . . . . 0.0 115.181 171.634 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 110.564 -0.161 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -72.11 156.6 39.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.911 1.284 . . . . 0.0 113.303 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 t -62.15 166.51 4.75 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.894 2.077 . . . . 0.0 114.342 -173.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -135.51 160.8 37.34 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.386 1.474 . . . . 0.0 110.095 168.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.6 tp -131.06 -67.87 0.69 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.91 0.884 . . . . 0.0 109.497 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -43.42 87.66 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.173 -0.918 . . . . 0.0 113.263 177.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -70.8 -40.61 72.42 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 118.863 0.756 . . . . 0.0 112.364 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.99 -44.35 87.12 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 117.695 0.225 . . . . 0.0 110.964 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -57.75 -33.61 68.66 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.982 1.313 . . . . 0.0 114.388 176.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 93.8 mt -70.92 -45.27 64.52 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.163 0.892 . . . . 0.0 111.497 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -62.17 -37.09 83.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.821 0.448 . . . . 0.0 111.632 171.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 76.4 m -67.26 -32.38 73.36 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 172.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -61.67 -25.87 67.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.817 -1.177 . . . . 0.0 112.42 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 m -61.85 -15.62 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 174.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -120.18 8.22 10.89 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 112.038 173.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.16 36.82 90.76 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.997 1.284 . . . . 0.0 113.755 -173.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 17.4 mt -109.24 159.93 16.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.663 1.185 . . . . 0.0 112.231 -177.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -89.77 150.12 22.42 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.864 2.065 . . . . 0.0 108.314 167.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.12 130.37 8.36 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 119.233 0.924 . . . . 0.0 111.763 174.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -134.67 147.2 50.08 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.786 1.634 . . . . 0.0 111.893 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.8 t -85.89 132.74 34.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 122.983 0.513 . . . . 0.0 111.2 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.3 pt -134.2 1.71 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -168.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.18 45.01 0.02 OUTLIER Glycine 0 N--CA 1.473 1.146 0 CA-C-N 119.484 1.038 . . . . 0.0 114.404 -173.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 62.02 25.11 15.03 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.008 1.323 . . . . 0.0 112.298 -169.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -158.32 147.56 19.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 128.202 2.601 . . . . 0.0 109.483 178.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -101.56 142.49 32.85 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 124.533 1.133 . . . . 0.0 111.813 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -127.85 134.17 49.4 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.821 1.248 . . . . 0.0 110.266 172.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.37 156.6 39.1 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 174.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.2 m -151.57 146.47 18.88 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 125.102 1.361 . . . . 0.0 111.646 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -81.08 62.68 8.6 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.867 3.045 . . . . 0.0 111.411 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.0 m80 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 127.94 2.496 . . . . 0.0 114.213 179.67 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -119.76 123.69 44.34 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.688 1.195 . . . . 0.0 110.899 177.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -89.68 115.08 26.79 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.301 1.04 . . . . 0.0 111.316 -169.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -92.35 166.51 12.54 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.737 -0.602 . . . . 0.0 109.938 167.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -130.38 -68.46 0.69 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 118.498 -0.763 . . . . 0.0 109.932 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -63.83 -47.3 81.33 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.934 1.243 . . . . 0.0 112.296 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -63.54 -38.2 90.21 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.563 0.62 . . . . 0.0 111.229 174.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.5 t -59.06 -46.01 89.33 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 172.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.61 -38.64 78.44 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.679 -1.263 . . . . 0.0 112.343 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.4 mt -71.72 -29.91 65.06 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -71.32 -39.53 71.33 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.901 0.881 . . . . 0.0 111.621 172.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 72.9 m -69.98 -27.98 65.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.709 1.204 . . . . 0.0 112.606 173.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 48.8 ttp85 -54.31 -32.48 56.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.925 1.29 . . . . 0.0 112.191 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.6 m -64.28 -7.19 8.58 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.0 mt -127.64 19.77 6.69 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.507 1.503 . . . . 0.0 111.723 169.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.88 20.7 70.8 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.203 0.906 . . . . 0.0 114.169 -175.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 31.4 mt -99.55 158.62 15.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.92 1.688 . . . . 0.0 111.662 -176.231 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -97.66 155.72 16.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.232 2.213 . . . . 0.0 109.157 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.53 125.61 6.77 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 124.231 0.92 . . . . 0.0 113.379 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -119.46 117.79 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.834 1.654 . . . . 0.0 111.129 179.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.0 t -73.25 122.03 21.3 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.804 -0.56 . . . . 0.0 110.428 172.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -87.33 -35.48 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 0.0 112.407 -174.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.79 -32.91 0.13 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.593 1.092 . . . . 0.0 114.925 173.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -138.32 -19.53 1.1 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.329 2.252 . . . . 0.0 111.908 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -134.64 148.49 50.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.226 1.811 . . . . 0.0 111.423 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -101.03 143.31 31.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.787 1.235 . . . . 0.0 112.93 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -119.87 141.77 49.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 127.223 2.209 . . . . 0.0 110.583 -175.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -91.14 152.31 20.63 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 171.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 m -153.65 153.89 29.57 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.501 1.52 . . . . 0.0 111.202 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.58 -17.8 26.17 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 121.832 1.688 . . . . 0.0 112.089 169.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 . . . . . 0 C--O 1.248 0.98 0 C-N-CA 127.064 2.146 . . . . 0.0 114.912 -174.837 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.475 0.178 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -113.43 153.6 28.35 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.33 1.452 . . . . 0.0 112.909 -174.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.55 134.61 52.74 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.746 1.618 . . . . 0.0 113.175 -175.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -93.33 159.64 15.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.256 1.022 . . . . 0.0 109.811 168.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -137.49 -65.24 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.341 0.656 . . . . 0.0 110.428 172.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.78 -23.78 66.42 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 177.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -89.1 -41.21 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.054 1.742 . . . . 0.0 111.99 169.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.3 t -58.93 -42.19 89.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.233 1.013 . . . . 0.0 112.159 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -56.95 -32.43 66.0 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.993 1.317 . . . . 0.0 114.111 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.0 mt -71.72 -40.27 69.57 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.632 -0.667 . . . . 0.0 111.732 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.5 t -73.83 -30.81 62.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.0 m -63.27 -36.68 84.48 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.088 -1.007 . . . . 0.0 113.13 172.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -59.07 -30.96 68.45 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.228 -0.92 . . . . 0.0 112.982 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -66.74 -14.3 62.4 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -114.79 6.62 15.58 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.53 1.532 . . . . 0.0 112.146 170.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.04 36.55 40.65 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.285 1.422 . . . . 0.0 114.609 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -123.34 160.78 26.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.595 1.558 . . . . 0.0 112.104 -169.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.6 mt -86.03 152.9 22.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.847 0.859 . . . . 0.0 108.728 165.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.56 128.94 9.71 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.855 0.741 . . . . 0.0 111.36 170.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -142.37 134.18 27.01 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.536 1.534 . . . . 0.0 111.653 -176.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 12.2 t -75.06 151.75 38.66 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -176.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.5 mt -97.98 -44.56 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.481 1.912 . . . . 0.0 109.689 169.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 168.69 -56.65 0.21 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.095 1.807 . . . . 0.0 110.905 177.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -126.71 11.12 7.22 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.371 1.468 . . . . 0.0 113.313 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -137.47 150.13 47.35 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 128.06 2.544 . . . . 0.0 109.887 168.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 39.2 t -105.38 147.28 28.38 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.778 0.831 . . . . 0.0 111.061 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -128.91 140.36 51.71 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.062 1.745 . . . . 0.0 111.038 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.2 m -88.86 146.79 24.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.246 0.618 . . . . 0.0 112.205 169.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.9 m -141.42 143.51 30.35 Favored Pre-proline 0 N--CA 1.482 1.127 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -84.29 57.3 5.21 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.582 3.521 . . . . 0.0 112.636 179.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 . . . . . 0 C--O 1.254 1.334 0 C-N-CA 127.833 2.453 . . . . 0.0 115.204 171.27 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 119.569 -0.253 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -52.29 160.42 0.8 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.629 1.172 . . . . 0.0 113.794 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.0 t -73.6 45.36 0.18 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.43 1.492 . . . . 0.0 114.139 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -68.51 159.28 32.1 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.442 -0.786 . . . . 0.0 109.332 168.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -127.06 -76.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.202 1.401 . . . . 0.0 109.128 171.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -64.71 -33.3 75.63 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 117.916 -1.04 . . . . 0.0 112.573 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -77.13 -33.52 56.77 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.151 0.981 . . . . 0.0 112.707 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.3 t -61.87 -42.89 99.6 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.844 0.747 . . . . 0.0 111.675 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -54.76 -32.06 59.46 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.229 1.012 . . . . 0.0 113.485 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.4 mt -69.71 -30.55 68.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.046 0.939 . . . . 0.0 112.88 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 72.2 m -75.11 -41.68 58.07 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.623 0.769 . . . . 0.0 110.866 169.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.48 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.8 m -65.5 -23.43 66.89 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.514 1.125 . . . . 0.0 113.682 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -51.21 -28.13 10.65 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.647 1.979 . . . . 0.0 113.087 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.9 t -51.33 -34.71 34.81 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.663 1.585 . . . . 0.0 113.586 175.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.1 mt -122.18 19.59 10.69 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.105 1.362 . . . . 0.0 112.646 -177.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.2 24.67 74.74 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.246 0.926 . . . . 0.0 114.088 -178.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 16.5 mt -102.02 159.58 15.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.449 1.5 . . . . 0.0 112.101 -175.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.7 mt -93.5 173.4 7.72 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 164.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -132.29 139.0 10.57 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -139.54 137.38 35.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.397 1.079 . . . . 0.0 110.215 -174.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.0 t -84.17 142.55 30.25 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 176.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.0 mt -142.72 117.52 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.782 1.633 . . . . 0.0 107.78 173.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.77 44.97 96.52 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.683 -0.635 . . . . 0.0 114.061 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 68.49 28.91 5.84 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -148.89 146.75 28.05 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.092 -1.63 . . . . 0.0 111.583 168.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -89.03 153.19 21.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 174.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -147.42 144.49 28.69 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.427 1.891 . . . . 0.0 110.362 172.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.6 m -83.85 153.43 24.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.75 143.35 14.01 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.45 1.5 . . . . 0.0 111.911 -177.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.76 -21.22 6.11 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.549 2.833 . . . . 0.0 114.52 -169.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 126.439 1.896 . . . . 0.0 114.026 -169.758 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -75.3 166.24 23.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 -170.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.3 t -74.96 59.21 0.9 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.608 1.563 . . . . 0.0 111.012 167.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -73.31 157.15 37.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.122 -0.986 . . . . 0.0 109.274 169.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -127.14 -72.09 0.65 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 117.879 -1.058 . . . . 0.0 110.988 171.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -62.01 -42.0 98.68 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 121.012 1.733 . . . . 0.0 112.922 173.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.3 mtt-85 -66.01 -35.95 81.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 118.757 0.708 . . . . 0.0 111.034 175.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.85 -42.42 97.57 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.103 0.961 . . . . 0.0 112.157 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.451 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 88.2 mt-10 -59.48 -29.83 68.11 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.927 -1.108 . . . . 0.0 112.909 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -72.52 -42.12 65.12 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.044 0.838 . . . . 0.0 112.595 170.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 m -62.28 -39.54 93.26 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.429 0.692 . . . . 0.0 111.637 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.0 m -70.73 -30.32 66.82 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.462 1.505 . . . . 0.0 113.405 175.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -57.0 -27.03 61.23 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.916 -1.115 . . . . 0.0 112.398 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.67 -17.84 50.07 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 175.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 98.8 mt -117.93 9.08 12.73 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.608 1.095 . . . . 0.0 112.914 170.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.13 18.39 74.62 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.73 1.157 . . . . 0.0 114.093 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 34.9 mt -95.06 176.51 6.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.06 1.744 . . . . 0.0 111.307 -178.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.03 168.76 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.691 1.996 . . . . 0.0 108.076 165.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.451 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -116.62 149.22 18.81 Favored Glycine 0 N--CA 1.471 1.016 0 C-N-CA 124.165 0.888 . . . . 0.0 114.178 -172.146 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -138.38 133.95 33.54 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.297 1.839 . . . . 0.0 109.464 170.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.4 t -75.25 142.46 43.35 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.307 -0.871 . . . . 0.0 111.228 172.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.4 mm -93.86 -30.27 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.629 1.172 . . . . 0.0 111.689 175.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 162.08 -39.7 0.38 Allowed Glycine 0 N--CA 1.472 1.084 0 C-N-CA 125.709 1.624 . . . . 0.0 114.112 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -124.61 -10.21 7.35 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.398 1.479 . . . . 0.0 112.338 174.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -148.92 154.25 39.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.524 1.93 . . . . 0.0 110.9 -176.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -96.87 152.32 18.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.027 0.931 . . . . 0.0 113.056 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -130.59 143.78 50.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.537 1.535 . . . . 0.0 110.349 169.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -84.07 158.82 21.3 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 m -144.81 139.96 15.86 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 126.517 1.927 . . . . 0.0 110.739 -175.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -92.76 -24.22 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.741 2.961 . . . . 0.0 116.656 -168.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 C--O 1.253 1.282 0 C-N-CA 126.995 2.118 . . . . 0.0 113.201 -168.834 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 120.505 0.193 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -77.64 163.28 26.36 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.539 1.135 . . . . 0.0 111.245 168.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -67.01 162.48 21.99 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -178.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -126.98 174.33 8.94 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.056 1.343 . . . . 0.0 111.038 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.73 -73.57 0.43 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.31 1.044 . . . . 0.0 110.391 168.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.3 tpp85 -57.62 -45.74 85.01 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.365 1.438 . . . . 0.0 112.051 175.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.78 -28.42 67.59 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.382 -0.823 . . . . 0.0 113.037 176.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.4 t -67.95 -43.94 77.91 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.616 0.766 . . . . 0.0 111.586 169.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.37 -39.78 88.45 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.65 -1.281 . . . . 0.0 113.339 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -40.98 91.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.18 0.592 . . . . 0.0 111.69 175.122 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.9 t -63.43 -39.14 93.69 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 173.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 90.3 m -69.0 -12.21 61.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.035 1.334 . . . . 0.0 114.597 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -54.32 -26.48 29.8 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 121.162 -0.961 . . . . 0.0 112.532 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.5 t -54.97 -38.32 67.64 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -116.72 20.01 14.21 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.364 1.465 . . . . 0.0 113.579 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.52 25.82 73.77 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 120.92 -1.113 . . . . 0.0 115.029 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.8 mt -90.18 170.85 9.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.504 1.521 . . . . 0.0 111.353 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 mt -113.11 152.63 29.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.255 1.422 . . . . 0.0 110.037 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.41 131.07 9.93 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.235 0.921 . . . . 0.0 113.682 -172.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -131.25 141.04 49.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.022 1.329 . . . . 0.0 111.86 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.57 125.82 32.18 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.346 1.058 . . . . 0.0 111.911 -177.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -75.44 -47.25 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.626 1.17 . . . . 0.0 111.19 -177.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.44 -34.54 0.12 Allowed Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.613 1.578 . . . . 0.0 113.461 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -120.86 -26.02 5.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.629 1.972 . . . . 0.0 112.549 171.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -140.2 152.36 45.93 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.294 1.838 . . . . 0.0 111.983 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.1 t -113.99 134.98 54.49 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.679 1.191 . . . . 0.0 112.853 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -138.8 159.06 43.03 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 0.0 112.604 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -80.49 162.69 24.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -171.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -143.47 142.34 20.95 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.48 1.512 . . . . 0.0 112.318 178.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -81.15 -12.22 11.83 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.054 3.169 . . . . 0.0 115.076 -174.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 . . . . . 0 C--O 1.258 1.519 0 CA-C-O 116.71 -1.614 . . . . 0.0 113.446 176.602 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.0 m . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.86 3.26 10.4 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -171.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp 37.33 -67.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.442 1 C-N-CA 135.624 5.569 . . . . 0.0 113.905 172.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 mtm105 -57.17 -49.13 76.93 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.68 1.592 . . . . 0.0 111.384 171.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -81.61 -29.49 33.26 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.432 1.093 . . . . 0.0 112.19 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.2 t -57.33 -49.37 76.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 122.948 0.499 . . . . 0.0 111.438 175.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.12 -47.23 75.29 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.466 1.506 . . . . 0.0 112.185 176.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.1 mt -66.6 -32.66 74.13 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -64.1 -47.12 81.25 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 122.41 0.284 . . . . 0.0 110.953 170.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.9 m -63.54 -23.5 67.42 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -60.76 -16.72 43.28 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.628 -1.295 . . . . 0.0 113.426 171.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.8 p -51.35 -33.84 31.28 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.384 0.993 . . . . 0.0 112.767 169.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.4 mt -113.01 11.15 18.93 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.757 1.223 . . . . 0.0 112.365 173.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 22.81 72.97 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.292 1.425 . . . . 0.0 113.943 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.3 mt -100.76 161.61 13.48 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.405 1.082 . . . . 0.0 113.043 -170.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.6 mt -79.54 143.4 34.86 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.716 1.606 . . . . 0.0 108.803 166.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.02 130.25 9.68 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 124.961 1.267 . . . . 0.0 112.533 178.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -138.38 156.66 47.39 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.18 1.392 . . . . 0.0 112.636 -172.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.14 137.02 32.7 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.449 1.1 . . . . 0.0 112.431 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 9.1 pt -135.31 44.53 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.699 1.199 . . . . 0.0 113.36 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 91.51 0.52 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.025 1.297 . . . . 0.0 110.827 -176.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 65.76 -6.89 0.39 Allowed 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 127.637 2.375 . . . . 0.0 117.097 175.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -133.09 142.73 48.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.076 1.35 . . . . 0.0 111.367 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.41 134.7 36.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.285 1.434 . . . . 0.0 111.386 172.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -144.21 135.17 25.24 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.78 0.832 . . . . 0.0 111.318 170.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -76.64 167.23 22.19 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.478 1.111 . . . . 0.0 113.09 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.4 m -141.55 142.66 26.85 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 112.428 -176.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.38 -4.5 15.52 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 124.393 3.395 . . . . 0.0 116.587 -169.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 32.0 m80 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 128.592 2.757 . . . . 0.0 116.825 -173.546 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 m . . . . . 0 CA--C 1.548 0.884 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -51.89 -48.62 64.01 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 123.47 1.605 . . . . 0.0 113.898 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? 62.8 -56.53 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 1 C-N-CA 133.45 4.7 . . . . 0.0 111.61 -173.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.32 -54.36 34.23 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.214 1.006 . . . . 0.0 112.277 -176.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -74.51 -30.87 61.97 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.84 172.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.5 t -58.45 -40.85 83.73 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.958 0.903 . . . . 0.0 112.886 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.62 -35.22 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.1 mt -59.44 -38.37 80.53 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.556 0.616 . . . . 0.0 112.128 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 m -79.75 -18.77 50.32 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.282 1.433 . . . . 0.0 113.793 177.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 72.3 m -85.42 -34.67 21.65 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.331 1.053 . . . . 0.0 112.892 176.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.4 mtp180 -51.91 -32.42 32.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.493 1.117 . . . . 0.0 112.659 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -61.61 -10.3 7.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.099 2.16 . . . . 0.0 116.289 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -126.34 7.0 7.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.726 1.21 . . . . 0.0 112.997 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.03 44.51 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.306 0.955 . . . . 0.0 114.325 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.45 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 17.7 mt -115.43 163.6 15.49 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.66 1.23 . . . . 0.0 112.799 -171.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.7 mt -108.81 155.84 20.32 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 126.091 1.756 . . . . 0.0 109.16 167.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -89.19 142.03 16.59 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 123.623 0.63 . . . . 0.0 111.652 172.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -137.53 134.13 35.33 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.087 1.355 . . . . 0.0 111.468 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -74.7 139.18 43.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.224 1.41 . . . . 0.0 111.681 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.3 pt -138.57 57.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 126.74 2.016 . . . . 0.0 111.224 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.11 91.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.731 0 C-N-CA 125.415 1.483 . . . . 0.0 112.4 177.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 64.19 2.88 1.58 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.229 1.812 . . . . 0.0 115.356 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -140.2 141.69 35.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.784 1.634 . . . . 0.0 111.917 -178.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.9 t -112.7 143.9 43.12 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.586 1.154 . . . . 0.0 112.395 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -152.2 155.71 38.31 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.207 2.203 . . . . 0.0 110.169 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.6 m -83.73 159.25 21.52 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -173.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.8 m -145.87 144.34 21.87 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 125.269 1.428 . . . . 0.0 112.376 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -82.09 -4.52 11.91 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.092 3.194 . . . . 0.0 113.356 176.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 125.548 1.539 . . . . 0.0 113.974 -174.495 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.4 m . . . . . 0 CA--C 1.546 0.801 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -66.78 -43.8 83.02 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 124.808 2.242 . . . . 0.0 113.075 173.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.4 tm? 62.34 -49.19 0.17 Allowed 'General case' 0 C--N 1.319 -0.73 1 C-N-CA 133.682 4.793 . . . . 0.0 113.532 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -73.39 -56.13 5.46 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.849 0.75 . . . . 0.0 110.842 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -60.74 -31.89 71.2 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.51 -0.744 . . . . 0.0 112.075 171.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.79 -52.32 66.2 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 168.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 89.6 mt-10 -60.16 -35.21 74.82 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.803 -1.185 . . . . 0.0 113.773 176.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.68 -46.63 78.33 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.922 0.889 . . . . 0.0 111.813 174.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -65.86 -41.57 91.48 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.043 -0.411 . . . . 0.0 111.707 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m -59.45 -29.07 67.53 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.271 -0.893 . . . . 0.0 113.307 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -61.11 -18.29 57.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 177.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -57.99 -27.65 63.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.148 1.34 . . . . 0.0 113.25 174.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -113.15 21.07 15.7 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.699 1.599 . . . . 0.0 111.731 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.44 -8.74 12.32 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.549 2.023 . . . . 0.0 116.143 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.41 161.13 31.23 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.25 1.82 . . . . 0.0 113.078 -169.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.2 mt -99.71 152.56 19.95 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.133 0.973 . . . . 0.0 109.416 165.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -99.32 141.69 15.65 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 124.84 1.21 . . . . 0.0 112.138 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 139.76 40.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.153 1.381 . . . . 0.0 110.127 172.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.4 t -75.62 128.37 35.1 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.86 0.864 . . . . 0.0 110.798 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -139.41 117.23 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.41 45.14 97.02 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 121.875 -0.516 . . . . 0.0 113.257 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 60.44 10.59 2.54 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -124.95 120.77 32.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.765 1.226 . . . . 0.0 110.606 170.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.4 t -74.85 132.28 41.39 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 174.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -126.43 153.76 44.59 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.085 1.754 . . . . 0.0 109.842 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.0 m -80.89 161.27 24.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.457 0.703 . . . . 0.0 111.324 170.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.78 138.23 32.66 Favored Pre-proline 0 N--CA 1.481 1.116 0 O-C-N 121.572 -0.705 . . . . 0.0 110.682 -178.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -72.05 -9.59 24.79 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 123.818 3.012 . . . . 0.0 115.07 -168.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.1 m80 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.486 1.914 . . . . 0.0 115.875 -175.696 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.3 m . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -66.74 -49.2 66.75 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 124.275 1.988 . . . . 0.0 112.052 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.9 tp 61.58 -51.1 0.13 Allowed 'General case' 0 C--N 1.32 -0.688 1 C-N-CA 133.157 4.583 . . . . 0.0 113.052 -171.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 71.3 mtm180 -73.84 -36.27 64.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -174.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -83.01 -36.54 24.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.039 1.736 . . . . 0.0 111.446 168.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.2 t -52.27 -45.73 65.54 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.071 0.548 . . . . 0.0 112.073 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.24 -39.38 72.46 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.155 0.982 . . . . 0.0 113.206 173.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.49 -39.17 77.81 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.014 0.926 . . . . 0.0 112.34 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -66.81 -39.21 87.63 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.436 0.694 . . . . 0.0 111.54 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 71.6 m -65.39 -34.63 78.76 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.961 0.904 . . . . 0.0 113.241 171.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -61.5 -25.66 67.41 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.162 0.985 . . . . 0.0 112.924 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.1 m -64.44 -10.94 28.46 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 172.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -126.63 4.6 6.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.468 1.907 . . . . 0.0 112.33 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.56 28.59 69.16 Favored Glycine 0 CA--C 1.532 1.15 0 O-C-N 121.318 -0.864 . . . . 0.0 114.24 -173.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 18.7 mt -109.45 167.95 9.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.427 1.491 . . . . 0.0 111.425 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 mt -112.0 142.47 44.38 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 108.914 168.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -105.43 136.32 13.11 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.606 1.098 . . . . 0.0 112.756 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -145.79 157.54 43.92 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.048 0.924 . . . . 0.0 112.533 170.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.73 123.29 28.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.7 0.8 . . . . 0.0 111.99 -177.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mm -88.6 60.2 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.447 1.499 . . . . 0.0 109.206 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.84 -54.51 2.99 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 126.242 1.877 . . . . 0.0 113.831 -170.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -153.75 11.26 0.43 Allowed 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -174.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -136.9 128.86 29.29 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.586 1.555 . . . . 0.0 107.953 168.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.8 t -81.71 150.73 27.85 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.171 -0.956 . . . . 0.0 111.772 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -150.26 135.52 17.96 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.002 0.521 . . . . 0.0 112.05 -173.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.3 m -82.11 155.41 25.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.861 0.864 . . . . 0.0 112.714 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.6 m -148.23 143.41 17.49 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 124.876 1.27 . . . . 0.0 111.365 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -77.66 -9.01 17.17 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.769 2.98 . . . . 0.0 115.333 -171.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.0 m80 . . . . . 0 C--O 1.249 1.074 0 C-N-CA 127.151 2.18 . . . . 0.0 113.999 -173.743 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.4 m . . . . . 0 C--O 1.238 0.461 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -92.56 167.2 12.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.797 1.239 . . . . 0.0 108.493 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.93 -53.04 0.47 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.37 169.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -59.59 -56.82 17.05 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.124 0.875 . . . . 0.0 112.085 169.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -66.15 -37.96 86.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.688 1.131 . . . . 0.0 112.624 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.6 t -60.57 -49.4 77.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.027 0.931 . . . . 0.0 111.878 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -63.08 -40.68 98.37 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 117.641 -1.171 . . . . 0.0 112.299 176.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.73 -45.93 88.54 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.651 1.569 . . . . 0.0 111.731 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 68.6 m -64.47 -32.39 74.0 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.1 m -82.74 -47.51 11.88 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -62.09 -20.26 63.83 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.937 1.295 . . . . 0.0 112.057 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -62.59 -23.72 67.19 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 171.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.2 mt -110.06 14.18 23.03 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.619 1.568 . . . . 0.0 111.995 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.35 20.13 76.57 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.738 1.161 . . . . 0.0 114.383 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.2 mt -92.77 162.23 14.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.522 1.529 . . . . 0.0 111.317 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -92.93 141.17 28.71 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.135 0.974 . . . . 0.0 108.781 167.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.3 132.34 11.08 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 124.808 1.194 . . . . 0.0 111.922 177.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.7 154.89 34.96 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.208 1.003 . . . . 0.0 112.849 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.5 t -91.18 132.17 36.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.536 1.134 . . . . 0.0 112.082 -174.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -75.13 -37.25 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.759 0.823 . . . . 0.0 110.604 170.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 165.48 -38.07 0.27 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 126.113 1.816 . . . . 0.0 111.839 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -148.82 7.53 0.74 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.064 2.145 . . . . 0.0 113.278 169.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.62 132.65 52.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.409 1.883 . . . . 0.0 111.325 173.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.06 141.42 45.73 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.437 1.095 . . . . 0.0 111.97 172.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -131.03 141.35 50.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.095 2.158 . . . . 0.0 111.105 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.1 m -103.87 153.7 20.46 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.077 0.951 . . . . 0.0 112.003 169.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.9 m -148.4 144.5 18.7 Favored Pre-proline 0 N--CA 1.484 1.229 0 C-N-CA 124.428 1.091 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -87.88 -14.57 3.5 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.722 2.948 . . . . 0.0 114.187 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--O 1.252 1.212 0 C-N-CA 126.562 1.945 . . . . 0.0 116.192 -168.562 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -93.83 178.93 5.51 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 162.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.78 -66.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.5 tpp85 -59.46 -49.05 79.3 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.067 0.849 . . . . 0.0 112.287 177.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -62.13 -35.21 78.06 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.057 0.943 . . . . 0.0 112.299 177.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -71.09 -50.54 32.61 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.221 1.408 . . . . 0.0 111.321 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.79 -37.19 75.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.864 1.666 . . . . 0.0 112.54 176.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.09 -40.34 82.68 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.775 1.23 . . . . 0.0 112.811 174.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.8 t -58.42 -46.77 85.82 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 169.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 78.2 m -68.97 -31.43 70.29 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -56.61 -33.73 66.54 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.801 1.24 . . . . 0.0 111.731 174.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.5 m -68.9 -3.15 11.59 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.8 mt -125.18 7.01 7.84 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 120.127 1.331 . . . . 0.0 111.769 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.9 27.76 71.73 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.799 1.19 . . . . 0.0 113.956 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.417 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 16.2 mt -110.15 161.61 15.4 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.049 1.74 . . . . 0.0 112.076 -178.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -96.96 148.91 22.49 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.579 1.151 . . . . 0.0 108.9 166.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -96.48 140.95 15.34 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.189 1.376 . . . . 0.0 112.126 174.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -136.12 134.56 38.46 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.961 1.704 . . . . 0.0 111.06 -178.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.5 t -76.89 137.88 39.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.188 0.595 . . . . 0.0 112.306 173.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -121.72 75.74 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.493 1.517 . . . . 0.0 108.853 172.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.35 -55.11 2.81 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.306 1.908 . . . . 0.0 114.526 175.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -146.91 -0.83 0.7 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.932 1.293 . . . . 0.0 114.326 -174.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -142.86 134.33 26.33 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.302 1.041 . . . . 0.0 110.776 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.8 t -97.13 138.77 34.13 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.007 0.923 . . . . 0.0 112.29 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -137.66 162.85 32.74 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.388 1.875 . . . . 0.0 112.066 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.5 m -80.32 161.83 24.86 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.64 143.43 32.41 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 123.404 0.682 . . . . 0.0 112.064 -176.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.63 -1.79 11.79 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.883 3.056 . . . . 0.0 114.529 -172.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.9 m80 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 125.158 1.383 . . . . 0.0 113.696 -169.525 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t . . . . . 0 CA--C 1.55 0.971 0 CA-C-O 120.984 0.421 . . . . 0.0 111.831 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -72.68 163.71 27.65 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.873 -1.142 . . . . 0.0 110.445 169.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -134.29 -71.33 0.5 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.254 1.021 . . . . 0.0 109.432 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 -55.17 -38.63 68.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.835 1.254 . . . . 0.0 112.919 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -86.75 -30.12 21.84 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.26 1.424 . . . . 0.0 113.817 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.6 t -62.78 -37.32 86.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.79 0.436 . . . . 0.0 111.424 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -52.1 -32.13 33.72 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.1 mt -78.25 -26.99 47.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.712 1.205 . . . . 0.0 112.337 -178.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.1 m -74.86 -41.94 58.87 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.546 0.738 . . . . 0.0 110.581 168.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.3 m -68.51 -23.46 64.55 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.399 1.079 . . . . 0.0 113.195 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -52.5 -26.11 12.1 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.311 1.844 . . . . 0.0 113.536 174.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 t -53.86 -34.33 59.01 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.3 mt -119.91 21.98 11.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.722 1.609 . . . . 0.0 112.157 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.09 23.95 71.56 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 123.972 0.796 . . . . 0.0 114.557 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 18.0 mt -94.01 163.93 13.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.131 1.372 . . . . 0.0 110.702 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -105.69 159.98 15.57 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.389 1.076 . . . . 0.0 108.398 166.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.57 138.47 13.94 Favored Glycine 0 CA--C 1.528 0.858 0 CA-C-O 118.622 -1.099 . . . . 0.0 111.671 177.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -137.29 135.58 37.25 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.827 2.051 . . . . 0.0 109.302 175.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.59 136.02 34.92 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.153 -0.967 . . . . 0.0 111.287 173.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.6 mt -120.72 100.46 9.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 124.883 1.273 . . . . 0.0 108.58 175.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 -66.98 2.4 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 127.222 2.344 . . . . 0.0 112.112 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -159.2 16.97 0.17 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.331 1.452 . . . . 0.0 112.974 -170.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -149.28 133.54 17.38 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.918 1.287 . . . . 0.0 110.315 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -84.04 133.28 34.67 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -118.35 156.67 28.53 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 127.994 2.518 . . . . 0.0 109.787 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -95.29 156.67 16.22 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.478 0.711 . . . . 0.0 112.442 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.2 m -142.0 140.89 20.33 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -85.97 70.55 4.58 Favored 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.755 4.304 . . . . 0.0 110.939 176.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.6 p80 . . . . . 0 C--O 1.25 1.111 0 C-N-CA 129.51 3.124 . . . . 0.0 117.491 -173.822 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.534 0.352 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -76.6 172.75 12.51 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.457 -0.777 . . . . 0.0 109.387 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.17 -59.51 1.04 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.423 168.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -62.29 -51.71 66.59 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.877 1.217 . . . . 0.0 112.07 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -65.0 -28.98 69.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.4 0.68 . . . . 0.0 112.068 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.3 t -68.06 -49.36 61.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 117.878 0.308 . . . . 0.0 111.114 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.85 -37.88 83.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.124 1.369 . . . . 0.0 112.545 174.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.07 -39.78 94.82 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.962 0.905 . . . . 0.0 112.471 172.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.9 m -68.95 -46.53 67.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.09 0.556 . . . . 0.0 111.583 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 85.5 m -62.72 -19.2 63.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.729 1.212 . . . . 0.0 114.051 176.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -55.56 -21.81 18.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.385 1.074 . . . . 0.0 112.522 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -56.12 -22.34 27.73 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.724 1.21 . . . . 0.0 114.003 173.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.9 mt -120.4 10.73 11.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.537 1.535 . . . . 0.0 112.881 170.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.88 24.87 76.65 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 124.674 1.131 . . . . 0.0 113.839 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 31.7 mt -97.84 168.59 10.22 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.985 1.314 . . . . 0.0 111.55 -177.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -106.24 171.95 7.07 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 164.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.72 138.45 9.95 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 123.902 0.763 . . . . 0.0 113.213 -168.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -142.16 144.9 33.66 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.744 1.617 . . . . 0.0 111.661 -173.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.64 157.05 34.23 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.651 1.58 . . . . 0.0 114.222 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 15.5 mt -140.35 78.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 128.168 2.587 . . . . 0.0 107.243 168.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -56.08 0.42 Allowed Glycine 0 CA--C 1.536 1.397 0 C-N-CA 128.442 2.925 . . . . 0.0 115.086 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -145.3 -8.28 0.6 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.716 2.006 . . . . 0.0 114.638 -176.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -111.76 129.34 56.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.331 1.452 . . . . 0.0 109.897 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.9 t -99.42 127.37 45.45 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.507 1.049 . . . . 0.0 111.922 174.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -131.2 145.08 51.79 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.078 1.751 . . . . 0.0 112.23 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.6 m -84.33 159.79 20.83 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.53 142.86 24.41 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.223 1.009 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -77.89 -4.1 14.14 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 124.667 3.578 . . . . 0.0 113.193 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.9 m80 . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.236 1.815 . . . . 0.0 114.097 -175.664 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.3 t . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -87.91 155.01 20.07 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.25 -0.907 . . . . 0.0 111.958 -174.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.61 -64.71 0.74 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.782 0.833 . . . . 0.0 109.439 174.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -59.78 -36.06 75.91 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -81.29 -35.1 31.48 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 119.306 0.957 . . . . 0.0 113.202 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.9 t -64.25 -42.83 96.33 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -56.21 -32.67 64.62 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 120.819 -1.175 . . . . 0.0 112.264 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 69.5 mt -73.69 -29.24 62.17 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.872 1.269 . . . . 0.0 113.435 175.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.2 t -69.92 -47.84 60.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.29 0.636 . . . . 0.0 110.578 169.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 76.6 m -59.62 -35.38 74.23 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.63 -0.669 . . . . 0.0 112.668 177.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -56.12 -23.18 32.7 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.149 1.38 . . . . 0.0 113.546 174.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.4 t -59.79 -28.25 67.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.302 1.041 . . . . 0.0 113.581 172.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -113.44 18.75 17.48 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.035 1.734 . . . . 0.0 111.089 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.67 5.52 24.54 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 126.995 2.236 . . . . 0.0 115.349 -173.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.443 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 32.8 mt -75.31 165.63 24.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.178 1.791 . . . . 0.0 113.042 -173.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 tp -98.57 160.43 14.28 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.814 2.046 . . . . 0.0 108.806 168.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -130.64 145.05 16.46 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-N 120.272 1.396 . . . . 0.0 114.658 -178.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.46 147.36 32.11 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 126.422 1.889 . . . . 0.0 112.063 175.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 t -81.85 120.01 24.65 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.278 0.49 . . . . 0.0 112.065 176.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -89.07 -63.64 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.579 -0.701 . . . . 0.0 111.449 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -151.52 73.83 0.27 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 125.236 1.398 . . . . 0.0 110.446 -178.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 61.18 22.06 12.42 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.954 1.701 . . . . 0.0 113.735 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.87 129.22 13.8 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 125.891 1.676 . . . . 0.0 110.381 169.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.2 t -76.01 129.2 36.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.795 1.238 . . . . 0.0 112.342 175.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -106.09 137.68 43.59 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.648 1.979 . . . . 0.0 109.489 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.0 m -87.34 147.23 25.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.974 0.416 . . . . 0.0 112.038 169.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.3 m -141.64 142.22 25.15 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 124.281 1.032 . . . . 0.0 112.775 -168.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.56 9.39 4.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.644 3.563 . . . . 0.0 114.504 -171.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.5 m80 . . . . . 0 C--O 1.25 1.085 0 C-N-CA 126.157 1.783 . . . . 0.0 114.23 179.305 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.548 0.888 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -94.06 159.31 15.22 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.241 -0.912 . . . . 0.0 110.85 169.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -127.82 -66.13 0.88 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.873 1.269 . . . . 0.0 108.624 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -62.73 -37.64 87.35 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.697 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -80.74 -33.01 35.43 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.987 0.812 . . . . 0.0 112.353 171.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.1 t -61.45 -42.32 98.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.825 0.739 . . . . 0.0 112.328 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -57.57 -22.29 43.94 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.755 -1.216 . . . . 0.0 113.813 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.1 mt -63.84 -24.97 67.96 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.539 1.063 . . . . 0.0 113.545 175.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -82.5 -44.66 15.68 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.949 -0.469 . . . . 0.0 111.175 169.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 79.6 m -67.6 -43.93 79.33 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.9 -18.25 65.21 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.115 0.966 . . . . 0.0 113.169 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.3 t -65.28 -24.12 67.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.463 0.705 . . . . 0.0 112.564 171.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -107.81 12.9 26.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.914 1.686 . . . . 0.0 111.904 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.57 22.56 77.91 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 125.294 1.426 . . . . 0.0 114.761 -176.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.45 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 27.8 mt -96.61 171.56 8.46 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.228 1.411 . . . . 0.0 112.701 -174.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.8 tp -108.3 147.28 31.68 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.198 2.599 . . . . 0.0 108.685 168.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.89 130.2 10.15 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.445 1.022 . . . . 0.0 113.057 173.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -140.0 149.44 43.23 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.28 1.832 . . . . 0.0 111.751 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.5 m -78.95 116.53 19.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.735 0.814 . . . . 0.0 111.875 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 7.8 tt -83.53 -11.25 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 125.732 1.613 . . . . 0.0 114.646 -172.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 175.3 -48.89 0.13 Allowed Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.944 1.735 . . . . 0.0 111.579 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -154.99 14.57 0.4 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.655 1.982 . . . . 0.0 112.566 168.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -142.05 146.9 36.0 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.237 1.815 . . . . 0.0 111.386 -175.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.9 t -86.37 127.0 34.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.69 0.677 . . . . 0.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -132.37 150.19 52.21 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.855 0.862 . . . . 0.0 112.777 172.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -87.77 149.11 24.39 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -169.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 m -146.28 144.07 20.51 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.127 1.371 . . . . 0.0 112.777 -174.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -88.76 0.69 6.35 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.304 3.336 . . . . 0.0 115.914 -170.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.1 m80 . . . . . 0 C--O 1.256 1.404 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -171.706 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.2 t . . . . . 0 CA--C 1.558 1.283 0 N-CA-C 115.273 1.582 . . . . 0.0 115.273 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.07 171.27 14.41 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.472 -1.392 . . . . 0.0 112.578 174.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -139.69 -59.52 0.56 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.312 1.045 . . . . 0.0 109.929 169.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.53 -23.36 66.86 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -93.64 -36.24 12.46 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.353 1.061 . . . . 0.0 112.514 169.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -67.49 -37.38 82.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.658 0.783 . . . . 0.0 113.084 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.87 -31.89 65.28 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.996 -1.065 . . . . 0.0 112.235 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 mt -64.79 -42.13 95.28 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.359 1.064 . . . . 0.0 112.895 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.8 p -78.09 -35.41 49.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.988 1.315 . . . . 0.0 112.416 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.1 m -70.48 -44.8 66.96 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 172.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -65.13 -21.89 66.85 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.595 -1.315 . . . . 0.0 112.894 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.6 m -61.46 -19.04 61.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 169.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.7 mt -112.18 13.62 20.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.406 1.882 . . . . 0.0 112.492 175.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 24.76 67.62 Favored Glycine 0 CA--C 1.54 1.621 0 C-N-CA 124.151 0.881 . . . . 0.0 115.266 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.1 mt -111.13 -179.15 3.65 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.457 2.303 . . . . 0.0 111.748 -174.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.8 mt -107.42 163.42 13.06 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.539 1.535 . . . . 0.0 107.96 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.92 132.03 9.63 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.53 1.538 . . . . 0.0 111.824 174.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -145.04 139.68 27.59 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.739 1.615 . . . . 0.0 111.285 -175.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.8 t -76.75 138.36 39.88 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.393 -0.817 . . . . 0.0 112.297 175.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.9 mm -82.39 -57.34 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.329 1.452 . . . . 0.0 110.728 170.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.04 -41.02 0.04 OUTLIER Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.158 0.885 . . . . 0.0 113.797 178.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -132.06 0.97 3.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.498 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -140.08 154.13 46.96 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.396 2.278 . . . . 0.0 110.296 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.1 t -110.87 137.31 48.67 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.54 0.736 . . . . 0.0 111.823 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -141.15 163.51 32.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.971 1.708 . . . . 0.0 110.627 -170.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.9 m -101.11 158.34 16.09 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -168.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -149.52 147.3 22.69 Favored Pre-proline 0 N--CA 1.483 1.189 0 C-N-CA 124.1 0.96 . . . . 0.0 113.466 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -84.22 63.24 6.84 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 125.297 3.998 . . . . 0.0 112.265 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.0 m80 . . . . . 0 C--O 1.252 1.224 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 172.802 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.5 m . . . . . 0 CA--C 1.546 0.8 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -78.36 174.57 11.12 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.431 -0.793 . . . . 0.0 110.938 167.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.8 tt -142.62 -63.76 0.42 Allowed 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.698 -0.626 . . . . 0.0 110.252 168.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -39.15 81.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.055 0.942 . . . . 0.0 112.025 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -78.71 -33.08 47.1 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.99 1.268 . . . . 0.0 112.837 172.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.1 t -67.49 -40.82 85.26 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.863 0.865 . . . . 0.0 112.441 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -60.23 -42.11 94.55 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.783 -1.198 . . . . 0.0 112.275 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.6 mt -66.89 -41.49 87.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.243 1.017 . . . . 0.0 112.074 174.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.8 t -63.25 -45.31 92.14 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.466 1.107 . . . . 0.0 112.199 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -70.2 -31.53 69.03 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -63.67 -24.04 67.62 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.936 -1.103 . . . . 0.0 112.414 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -66.55 1.57 1.66 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 170.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -128.16 4.14 5.82 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.657 1.983 . . . . 0.0 111.48 167.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.11 31.41 38.83 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 126.382 1.944 . . . . 0.0 114.402 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -121.68 159.79 25.83 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.907 1.353 . . . . 0.0 112.6 -170.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.4 tp -87.39 148.64 24.92 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.016 1.727 . . . . 0.0 109.341 168.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -108.36 128.59 9.17 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.584 1.088 . . . . 0.0 113.411 175.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -141.99 143.15 33.06 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 127.563 2.345 . . . . 0.0 112.147 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.6 t -72.55 146.85 46.46 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.374 1.069 . . . . 0.0 113.137 174.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.3 pt -123.16 10.36 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 125.436 1.494 . . . . 0.0 114.37 171.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.15 -58.42 0.51 Allowed Glycine 0 CA--C 1.53 0.984 0 C-N-CA 125.373 1.463 . . . . 0.0 112.157 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -142.09 -0.11 1.32 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.85 1.26 . . . . 0.0 113.298 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -125.33 135.35 52.37 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.891 1.677 . . . . 0.0 109.774 170.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.7 t -90.29 117.29 28.92 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.956 -0.465 . . . . 0.0 110.05 168.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -102.59 165.85 10.85 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.869 1.268 . . . . 0.0 112.02 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -102.54 148.44 25.53 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.5 m -150.75 152.94 33.05 Favored Pre-proline 0 N--CA 1.478 0.966 0 C-N-CA 124.971 1.308 . . . . 0.0 112.417 -173.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -77.19 68.42 7.41 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.704 3.602 . . . . 0.0 110.424 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.9 m80 . . . . . 0 C--O 1.248 1.014 0 C-N-CA 128.626 2.77 . . . . 0.0 114.072 169.793 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.5 t . . . . . 0 CA--C 1.537 0.461 0 CA-C-O 118.852 -0.594 . . . . 0.0 111.646 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.48 165.77 16.02 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.51 1.05 . . . . 0.0 111.958 173.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -133.55 -62.64 0.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 108.363 169.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 79.1 mtp85 -61.59 -38.08 86.25 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -88.86 -20.91 24.01 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 169.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.3 t -63.83 -42.17 97.68 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.159 0.891 . . . . 0.0 111.389 173.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -50.03 -42.01 48.6 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.479 1.112 . . . . 0.0 112.769 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.67 -30.39 70.7 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.672 1.189 . . . . 0.0 112.59 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -73.17 -48.47 35.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.937 0.895 . . . . 0.0 111.742 171.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.436 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.9 m -60.68 -31.5 70.75 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -62.43 -17.78 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.746 1.218 . . . . 0.0 114.162 175.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.3 p -57.53 -24.7 57.52 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.82 1.191 . . . . 0.0 114.03 170.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 77.7 mt -124.09 16.5 9.21 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.52 1.928 . . . . 0.0 112.044 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.49 25.6 70.21 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.362 0.982 . . . . 0.0 114.801 -177.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 27.4 mt -86.65 169.23 12.89 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.308 1.443 . . . . 0.0 111.763 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -98.88 140.77 32.55 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.924 2.49 . . . . 0.0 108.412 168.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.08 136.57 12.76 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.424 1.011 . . . . 0.0 113.654 177.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -141.78 138.99 32.67 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.925 1.69 . . . . 0.0 112.277 177.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -77.36 133.86 38.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.709 0.804 . . . . 0.0 112.521 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.4 mm -86.35 -37.73 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.827 0.851 . . . . 0.0 112.011 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 170.55 -53.13 0.19 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.716 1.151 . . . . 0.0 112.829 175.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -123.24 -3.31 8.48 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.416 1.886 . . . . 0.0 112.921 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -150.04 144.63 25.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.322 1.849 . . . . 0.0 111.099 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.9 t -91.34 145.95 24.22 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.014 0.925 . . . . 0.0 113.439 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.5 tptt -128.78 132.36 47.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.304 2.642 . . . . 0.0 109.596 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -83.1 157.61 22.76 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.676 0.79 . . . . 0.0 113.094 176.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.1 m -149.9 147.59 22.9 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 125.839 1.655 . . . . 0.0 111.034 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -90.16 25.62 0.55 Allowed 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.765 2.976 . . . . 0.0 115.205 -169.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 . . . . . 0 C--O 1.253 1.253 0 CA-C-O 116.999 -1.477 . . . . 0.0 113.846 -179.009 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.865 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -129.28 164.38 23.62 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.064 1.746 . . . . 0.0 110.662 169.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.6 tp -136.06 -61.34 0.71 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.152 0.981 . . . . 0.0 111.187 173.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.6 ttm-85 -61.18 -42.04 97.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.759 0.824 . . . . 0.0 112.26 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 tpp180 -68.42 -44.71 74.41 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.618 1.567 . . . . 0.0 111.866 168.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -55.36 -40.26 71.06 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.815 0.846 . . . . 0.0 112.377 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -61.26 -36.82 81.06 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.694 -1.254 . . . . 0.0 114.06 173.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 71.3 mt -71.03 -36.12 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.606 0.762 . . . . 0.0 111.846 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.3 m -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.465 1.106 . . . . 0.0 113.124 173.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.8 m -82.44 -12.53 57.8 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.0 mtm180 -53.73 -23.56 12.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.803 0.841 . . . . 0.0 112.655 167.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 99.0 p -41.85 -37.06 1.18 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.851 2.06 . . . . 0.0 114.915 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -133.35 19.07 3.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.708 2.003 . . . . 0.0 111.491 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.21 16.87 77.1 Favored Glycine 0 CA--C 1.537 1.435 0 C-N-CA 125.204 1.383 . . . . 0.0 115.178 -178.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.5 mt -94.43 166.93 11.82 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.653 1.581 . . . . 0.0 112.939 -170.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 mt -90.02 160.75 16.19 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.793 -1.094 . . . . 0.0 108.96 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -114.57 144.13 18.26 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.391 0.995 . . . . 0.0 112.701 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -140.99 151.76 44.38 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.226 1.81 . . . . 0.0 110.892 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 t -91.24 113.82 26.18 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 168.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.0 mt -129.7 104.77 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -174.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.49 54.85 17.43 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.124 0.868 . . . . 0.0 113.122 -175.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 60.37 18.42 8.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.962 1.705 . . . . 0.0 114.92 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -144.37 143.42 30.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.879 1.672 . . . . 0.0 112.409 176.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.9 t -70.67 137.7 50.04 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.807 1.243 . . . . 0.0 110.989 178.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -157.03 161.2 39.53 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.94 1.296 . . . . 0.0 111.764 168.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.5 m -94.33 159.92 14.91 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -169.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -147.79 148.92 31.89 Favored Pre-proline 0 N--CA 1.478 0.928 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -168.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -82.67 60.08 7.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.255 3.97 . . . . 0.0 112.648 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.1 m80 . . . . . 0 C--O 1.248 1.018 0 C-N-CA 127.735 2.414 . . . . 0.0 115.181 171.634 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -135.51 160.8 37.34 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.386 1.474 . . . . 0.0 110.095 168.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.6 tp -131.06 -67.87 0.69 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.91 0.884 . . . . 0.0 109.497 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -43.42 87.66 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.173 -0.918 . . . . 0.0 113.263 177.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -70.8 -40.61 72.42 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 118.863 0.756 . . . . 0.0 112.364 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.99 -44.35 87.12 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 117.695 0.225 . . . . 0.0 110.964 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -57.75 -33.61 68.66 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.982 1.313 . . . . 0.0 114.388 176.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 93.8 mt -70.92 -45.27 64.52 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.163 0.892 . . . . 0.0 111.497 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -62.17 -37.09 83.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.821 0.448 . . . . 0.0 111.632 171.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 76.4 m -67.26 -32.38 73.36 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 172.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -61.67 -25.87 67.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.817 -1.177 . . . . 0.0 112.42 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 m -61.85 -15.62 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 174.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -120.18 8.22 10.89 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 112.038 173.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.16 36.82 90.76 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.997 1.284 . . . . 0.0 113.755 -173.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 17.4 mt -109.24 159.93 16.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.663 1.185 . . . . 0.0 112.231 -177.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -89.77 150.12 22.42 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.864 2.065 . . . . 0.0 108.314 167.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.12 130.37 8.36 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 119.233 0.924 . . . . 0.0 111.763 174.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -134.67 147.2 50.08 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.786 1.634 . . . . 0.0 111.893 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.8 t -85.89 132.74 34.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 122.983 0.513 . . . . 0.0 111.2 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.3 pt -134.2 1.71 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -168.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.18 45.01 0.02 OUTLIER Glycine 0 N--CA 1.473 1.146 0 CA-C-N 119.484 1.038 . . . . 0.0 114.404 -173.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 62.02 25.11 15.03 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.008 1.323 . . . . 0.0 112.298 -169.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -158.32 147.56 19.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 128.202 2.601 . . . . 0.0 109.483 178.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -101.56 142.49 32.85 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 124.533 1.133 . . . . 0.0 111.813 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -127.85 134.17 49.4 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.821 1.248 . . . . 0.0 110.266 172.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.37 156.6 39.1 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 174.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.2 m -151.57 146.47 18.88 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 125.102 1.361 . . . . 0.0 111.646 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -81.08 62.68 8.6 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.867 3.045 . . . . 0.0 111.411 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.0 m80 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 127.94 2.496 . . . . 0.0 114.213 179.67 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.535 0.381 0 CA-C-O 119.807 -0.14 . . . . 0.0 111.316 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -92.35 166.51 12.54 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.737 -0.602 . . . . 0.0 109.938 167.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -130.38 -68.46 0.69 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 118.498 -0.763 . . . . 0.0 109.932 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -63.83 -47.3 81.33 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.934 1.243 . . . . 0.0 112.296 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -63.54 -38.2 90.21 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.563 0.62 . . . . 0.0 111.229 174.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.5 t -59.06 -46.01 89.33 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 172.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.61 -38.64 78.44 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.679 -1.263 . . . . 0.0 112.343 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.4 mt -71.72 -29.91 65.06 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -71.32 -39.53 71.33 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.901 0.881 . . . . 0.0 111.621 172.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 72.9 m -69.98 -27.98 65.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.709 1.204 . . . . 0.0 112.606 173.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 48.8 ttp85 -54.31 -32.48 56.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.925 1.29 . . . . 0.0 112.191 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.6 m -64.28 -7.19 8.58 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.0 mt -127.64 19.77 6.69 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.507 1.503 . . . . 0.0 111.723 169.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.88 20.7 70.8 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.203 0.906 . . . . 0.0 114.169 -175.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 31.4 mt -99.55 158.62 15.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.92 1.688 . . . . 0.0 111.662 -176.231 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -97.66 155.72 16.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.232 2.213 . . . . 0.0 109.157 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.53 125.61 6.77 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 124.231 0.92 . . . . 0.0 113.379 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -119.46 117.79 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.834 1.654 . . . . 0.0 111.129 179.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.0 t -73.25 122.03 21.3 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.804 -0.56 . . . . 0.0 110.428 172.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -87.33 -35.48 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 0.0 112.407 -174.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.79 -32.91 0.13 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.593 1.092 . . . . 0.0 114.925 173.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -138.32 -19.53 1.1 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.329 2.252 . . . . 0.0 111.908 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -134.64 148.49 50.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.226 1.811 . . . . 0.0 111.423 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -101.03 143.31 31.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.787 1.235 . . . . 0.0 112.93 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -119.87 141.77 49.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 127.223 2.209 . . . . 0.0 110.583 -175.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -91.14 152.31 20.63 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 171.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 m -153.65 153.89 29.57 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.501 1.52 . . . . 0.0 111.202 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.58 -17.8 26.17 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 121.832 1.688 . . . . 0.0 112.089 169.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 . . . . . 0 C--O 1.248 0.98 0 C-N-CA 127.064 2.146 . . . . 0.0 114.912 -174.837 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.1 t . . . . . 0 CA--C 1.543 0.688 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -93.33 159.64 15.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.256 1.022 . . . . 0.0 109.811 168.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -137.49 -65.24 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.341 0.656 . . . . 0.0 110.428 172.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.78 -23.78 66.42 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 177.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -89.1 -41.21 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.054 1.742 . . . . 0.0 111.99 169.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.3 t -58.93 -42.19 89.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.233 1.013 . . . . 0.0 112.159 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -56.95 -32.43 66.0 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.993 1.317 . . . . 0.0 114.111 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.0 mt -71.72 -40.27 69.57 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.632 -0.667 . . . . 0.0 111.732 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.5 t -73.83 -30.81 62.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.0 m -63.27 -36.68 84.48 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.088 -1.007 . . . . 0.0 113.13 172.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -59.07 -30.96 68.45 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.228 -0.92 . . . . 0.0 112.982 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -66.74 -14.3 62.4 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -114.79 6.62 15.58 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.53 1.532 . . . . 0.0 112.146 170.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.04 36.55 40.65 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.285 1.422 . . . . 0.0 114.609 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -123.34 160.78 26.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.595 1.558 . . . . 0.0 112.104 -169.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.6 mt -86.03 152.9 22.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.847 0.859 . . . . 0.0 108.728 165.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.56 128.94 9.71 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.855 0.741 . . . . 0.0 111.36 170.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -142.37 134.18 27.01 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.536 1.534 . . . . 0.0 111.653 -176.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 12.2 t -75.06 151.75 38.66 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -176.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.5 mt -97.98 -44.56 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.481 1.912 . . . . 0.0 109.689 169.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 168.69 -56.65 0.21 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.095 1.807 . . . . 0.0 110.905 177.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -126.71 11.12 7.22 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.371 1.468 . . . . 0.0 113.313 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -137.47 150.13 47.35 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 128.06 2.544 . . . . 0.0 109.887 168.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 39.2 t -105.38 147.28 28.38 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.778 0.831 . . . . 0.0 111.061 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -128.91 140.36 51.71 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.062 1.745 . . . . 0.0 111.038 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.2 m -88.86 146.79 24.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.246 0.618 . . . . 0.0 112.205 169.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.9 m -141.42 143.51 30.35 Favored Pre-proline 0 N--CA 1.482 1.127 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -84.29 57.3 5.21 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.582 3.521 . . . . 0.0 112.636 179.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 . . . . . 0 C--O 1.254 1.334 0 C-N-CA 127.833 2.453 . . . . 0.0 115.204 171.27 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.0 t . . . . . 0 CA--C 1.551 0.997 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -68.51 159.28 32.1 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.442 -0.786 . . . . 0.0 109.332 168.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -127.06 -76.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.202 1.401 . . . . 0.0 109.128 171.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -64.71 -33.3 75.63 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 117.916 -1.04 . . . . 0.0 112.573 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -77.13 -33.52 56.77 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.151 0.981 . . . . 0.0 112.707 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.3 t -61.87 -42.89 99.6 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.844 0.747 . . . . 0.0 111.675 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -54.76 -32.06 59.46 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.229 1.012 . . . . 0.0 113.485 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.4 mt -69.71 -30.55 68.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.046 0.939 . . . . 0.0 112.88 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 72.2 m -75.11 -41.68 58.07 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.623 0.769 . . . . 0.0 110.866 169.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.48 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.8 m -65.5 -23.43 66.89 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.514 1.125 . . . . 0.0 113.682 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -51.21 -28.13 10.65 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.647 1.979 . . . . 0.0 113.087 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.9 t -51.33 -34.71 34.81 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.663 1.585 . . . . 0.0 113.586 175.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.1 mt -122.18 19.59 10.69 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.105 1.362 . . . . 0.0 112.646 -177.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.2 24.67 74.74 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.246 0.926 . . . . 0.0 114.088 -178.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 16.5 mt -102.02 159.58 15.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.449 1.5 . . . . 0.0 112.101 -175.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.7 mt -93.5 173.4 7.72 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 164.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -132.29 139.0 10.57 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -139.54 137.38 35.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.397 1.079 . . . . 0.0 110.215 -174.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.0 t -84.17 142.55 30.25 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 176.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.0 mt -142.72 117.52 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.782 1.633 . . . . 0.0 107.78 173.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.77 44.97 96.52 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.683 -0.635 . . . . 0.0 114.061 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 68.49 28.91 5.84 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -148.89 146.75 28.05 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.092 -1.63 . . . . 0.0 111.583 168.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -89.03 153.19 21.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 174.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -147.42 144.49 28.69 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.427 1.891 . . . . 0.0 110.362 172.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.6 m -83.85 153.43 24.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.75 143.35 14.01 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.45 1.5 . . . . 0.0 111.911 -177.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.76 -21.22 6.11 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.549 2.833 . . . . 0.0 114.52 -169.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 126.439 1.896 . . . . 0.0 114.026 -169.758 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.3 t . . . . . 0 CA--C 1.551 1.015 0 CA-C-O 121.732 0.777 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -73.31 157.15 37.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.122 -0.986 . . . . 0.0 109.274 169.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -127.14 -72.09 0.65 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 117.879 -1.058 . . . . 0.0 110.988 171.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -62.01 -42.0 98.68 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 121.012 1.733 . . . . 0.0 112.922 173.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.3 mtt-85 -66.01 -35.95 81.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 118.757 0.708 . . . . 0.0 111.034 175.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.85 -42.42 97.57 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.103 0.961 . . . . 0.0 112.157 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.451 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 88.2 mt-10 -59.48 -29.83 68.11 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.927 -1.108 . . . . 0.0 112.909 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -72.52 -42.12 65.12 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.044 0.838 . . . . 0.0 112.595 170.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 m -62.28 -39.54 93.26 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.429 0.692 . . . . 0.0 111.637 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.0 m -70.73 -30.32 66.82 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.462 1.505 . . . . 0.0 113.405 175.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -57.0 -27.03 61.23 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.916 -1.115 . . . . 0.0 112.398 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.67 -17.84 50.07 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 175.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 98.8 mt -117.93 9.08 12.73 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.608 1.095 . . . . 0.0 112.914 170.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.13 18.39 74.62 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.73 1.157 . . . . 0.0 114.093 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 34.9 mt -95.06 176.51 6.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.06 1.744 . . . . 0.0 111.307 -178.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.03 168.76 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.691 1.996 . . . . 0.0 108.076 165.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.451 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -116.62 149.22 18.81 Favored Glycine 0 N--CA 1.471 1.016 0 C-N-CA 124.165 0.888 . . . . 0.0 114.178 -172.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -138.38 133.95 33.54 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.297 1.839 . . . . 0.0 109.464 170.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.4 t -75.25 142.46 43.35 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.307 -0.871 . . . . 0.0 111.228 172.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.4 mm -93.86 -30.27 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.629 1.172 . . . . 0.0 111.689 175.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 162.08 -39.7 0.38 Allowed Glycine 0 N--CA 1.472 1.084 0 C-N-CA 125.709 1.624 . . . . 0.0 114.112 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -124.61 -10.21 7.35 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.398 1.479 . . . . 0.0 112.338 174.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -148.92 154.25 39.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.524 1.93 . . . . 0.0 110.9 -176.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -96.87 152.32 18.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.027 0.931 . . . . 0.0 113.056 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -130.59 143.78 50.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.537 1.535 . . . . 0.0 110.349 169.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -84.07 158.82 21.3 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 m -144.81 139.96 15.86 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 126.517 1.927 . . . . 0.0 110.739 -175.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -92.76 -24.22 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.741 2.961 . . . . 0.0 116.656 -168.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 C--O 1.253 1.282 0 C-N-CA 126.995 2.118 . . . . 0.0 113.201 -168.834 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.552 1.021 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -126.98 174.33 8.94 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.056 1.343 . . . . 0.0 111.038 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.73 -73.57 0.43 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.31 1.044 . . . . 0.0 110.391 168.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.3 tpp85 -57.62 -45.74 85.01 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.365 1.438 . . . . 0.0 112.051 175.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.78 -28.42 67.59 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.382 -0.823 . . . . 0.0 113.037 176.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.4 t -67.95 -43.94 77.91 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.616 0.766 . . . . 0.0 111.586 169.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.37 -39.78 88.45 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.65 -1.281 . . . . 0.0 113.339 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -40.98 91.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.18 0.592 . . . . 0.0 111.69 175.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.9 t -63.43 -39.14 93.69 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 173.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 90.3 m -69.0 -12.21 61.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.035 1.334 . . . . 0.0 114.597 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -54.32 -26.48 29.8 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 121.162 -0.961 . . . . 0.0 112.532 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.5 t -54.97 -38.32 67.64 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -116.72 20.01 14.21 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.364 1.465 . . . . 0.0 113.579 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.52 25.82 73.77 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 120.92 -1.113 . . . . 0.0 115.029 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.8 mt -90.18 170.85 9.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.504 1.521 . . . . 0.0 111.353 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 mt -113.11 152.63 29.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.255 1.422 . . . . 0.0 110.037 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.41 131.07 9.93 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.235 0.921 . . . . 0.0 113.682 -172.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -131.25 141.04 49.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.022 1.329 . . . . 0.0 111.86 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.57 125.82 32.18 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.346 1.058 . . . . 0.0 111.911 -177.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -75.44 -47.25 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.626 1.17 . . . . 0.0 111.19 -177.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.44 -34.54 0.12 Allowed Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.613 1.578 . . . . 0.0 113.461 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -120.86 -26.02 5.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.629 1.972 . . . . 0.0 112.549 171.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -140.2 152.36 45.93 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.294 1.838 . . . . 0.0 111.983 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.1 t -113.99 134.98 54.49 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.679 1.191 . . . . 0.0 112.853 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -138.8 159.06 43.03 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 0.0 112.604 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -80.49 162.69 24.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -171.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -143.47 142.34 20.95 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.48 1.512 . . . . 0.0 112.318 178.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -81.15 -12.22 11.83 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.054 3.169 . . . . 0.0 115.076 -174.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 . . . . . 0 C--O 1.258 1.519 0 CA-C-O 116.71 -1.614 . . . . 0.0 113.446 176.602 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 118.078 -0.963 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -144.61 155.12 43.47 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.832 0.853 . . . . 0.0 112.112 178.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.0 m -78.91 70.33 5.23 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.191 0.996 . . . . 0.0 109.097 166.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.86 3.26 10.4 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -171.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 26.5 tp 37.33 -67.6 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.442 1 C-N-CA 135.624 5.569 . . . . 0.0 113.905 172.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 mtm105 -57.17 -49.13 76.93 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.68 1.592 . . . . 0.0 111.384 171.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -81.61 -29.49 33.26 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.432 1.093 . . . . 0.0 112.19 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.2 t -57.33 -49.37 76.35 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 122.948 0.499 . . . . 0.0 111.438 175.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -55.12 -47.23 75.29 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.466 1.506 . . . . 0.0 112.185 176.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.1 mt -66.6 -32.66 74.13 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -64.1 -47.12 81.25 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 122.41 0.284 . . . . 0.0 110.953 170.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 68.9 m -63.54 -23.5 67.42 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -60.76 -16.72 43.28 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.628 -1.295 . . . . 0.0 113.426 171.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.8 p -51.35 -33.84 31.28 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.384 0.993 . . . . 0.0 112.767 169.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.4 mt -113.01 11.15 18.93 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.757 1.223 . . . . 0.0 112.365 173.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 22.81 72.97 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.292 1.425 . . . . 0.0 113.943 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.3 mt -100.76 161.61 13.48 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.405 1.082 . . . . 0.0 113.043 -170.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.6 mt -79.54 143.4 34.86 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.716 1.606 . . . . 0.0 108.803 166.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.02 130.25 9.68 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 124.961 1.267 . . . . 0.0 112.533 178.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -138.38 156.66 47.39 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.18 1.392 . . . . 0.0 112.636 -172.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.14 137.02 32.7 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.449 1.1 . . . . 0.0 112.431 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 9.1 pt -135.31 44.53 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.699 1.199 . . . . 0.0 113.36 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 91.51 0.52 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 125.025 1.297 . . . . 0.0 110.827 -176.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 65.76 -6.89 0.39 Allowed 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 127.637 2.375 . . . . 0.0 117.097 175.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -133.09 142.73 48.89 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.076 1.35 . . . . 0.0 111.367 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 6.5 t -79.41 134.7 36.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.285 1.434 . . . . 0.0 111.386 172.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -144.21 135.17 25.24 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.78 0.832 . . . . 0.0 111.318 170.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -76.64 167.23 22.19 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.478 1.111 . . . . 0.0 113.09 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.4 m -141.55 142.66 26.85 Favored Pre-proline 0 N--CA 1.48 1.062 0 C-N-CA 123.756 0.822 . . . . 0.0 112.428 -176.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.38 -4.5 15.52 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 124.393 3.395 . . . . 0.0 116.587 -169.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 32.0 m80 . . . . . 0 C--O 1.252 1.225 0 C-N-CA 128.592 2.757 . . . . 0.0 116.825 -173.546 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.794 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -68.16 174.44 3.9 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.041 1.336 . . . . 0.0 113.644 -177.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 m -70.12 48.75 0.1 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.207 1.403 . . . . 0.0 114.69 177.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -51.89 -48.62 64.01 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 123.47 1.605 . . . . 0.0 113.898 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? 62.8 -56.53 0.15 Allowed 'General case' 0 C--N 1.321 -0.644 1 C-N-CA 133.45 4.7 . . . . 0.0 111.61 -173.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.32 -54.36 34.23 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.214 1.006 . . . . 0.0 112.277 -176.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -74.51 -30.87 61.97 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.84 172.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.5 t -58.45 -40.85 83.73 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.958 0.903 . . . . 0.0 112.886 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -58.62 -35.22 72.12 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 83.1 mt -59.44 -38.37 80.53 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.556 0.616 . . . . 0.0 112.128 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.3 m -79.75 -18.77 50.32 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.282 1.433 . . . . 0.0 113.793 177.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 72.3 m -85.42 -34.67 21.65 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.331 1.053 . . . . 0.0 112.892 176.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.4 mtp180 -51.91 -32.42 32.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.493 1.117 . . . . 0.0 112.659 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -61.61 -10.3 7.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.099 2.16 . . . . 0.0 116.289 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.0 mt -126.34 7.0 7.04 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.726 1.21 . . . . 0.0 112.997 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.77 22.03 44.51 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.306 0.955 . . . . 0.0 114.325 -174.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.45 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 17.7 mt -115.43 163.6 15.49 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.66 1.23 . . . . 0.0 112.799 -171.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.7 mt -108.81 155.84 20.32 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 126.091 1.756 . . . . 0.0 109.16 167.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -89.19 142.03 16.59 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 123.623 0.63 . . . . 0.0 111.652 172.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -137.53 134.13 35.33 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.087 1.355 . . . . 0.0 111.468 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -74.7 139.18 43.29 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.224 1.41 . . . . 0.0 111.681 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.3 pt -138.57 57.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 126.74 2.016 . . . . 0.0 111.224 178.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.11 91.77 0.08 OUTLIER Glycine 0 CA--C 1.526 0.731 0 C-N-CA 125.415 1.483 . . . . 0.0 112.4 177.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 64.19 2.88 1.58 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.229 1.812 . . . . 0.0 115.356 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -140.2 141.69 35.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.784 1.634 . . . . 0.0 111.917 -178.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.9 t -112.7 143.9 43.12 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.586 1.154 . . . . 0.0 112.395 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -152.2 155.71 38.31 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.207 2.203 . . . . 0.0 110.169 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.6 m -83.73 159.25 21.52 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -173.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.8 m -145.87 144.34 21.87 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 125.269 1.428 . . . . 0.0 112.376 -178.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -82.09 -4.52 11.91 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.092 3.194 . . . . 0.0 113.356 176.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 26.5 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 125.548 1.539 . . . . 0.0 113.974 -174.495 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 110.595 -0.15 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -123.33 170.42 10.33 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.647 1.179 . . . . 0.0 111.622 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 65.4 m -72.87 117.44 14.58 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -66.78 -43.8 83.02 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 124.808 2.242 . . . . 0.0 113.075 173.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.4 tm? 62.34 -49.19 0.17 Allowed 'General case' 0 C--N 1.319 -0.73 1 C-N-CA 133.682 4.793 . . . . 0.0 113.532 -173.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -73.39 -56.13 5.46 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.849 0.75 . . . . 0.0 110.842 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -60.74 -31.89 71.2 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.51 -0.744 . . . . 0.0 112.075 171.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -58.79 -52.32 66.2 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 168.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 89.6 mt-10 -60.16 -35.21 74.82 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.803 -1.185 . . . . 0.0 113.773 176.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.68 -46.63 78.33 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.922 0.889 . . . . 0.0 111.813 174.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -65.86 -41.57 91.48 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 122.043 -0.411 . . . . 0.0 111.707 176.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.1 m -59.45 -29.07 67.53 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.271 -0.893 . . . . 0.0 113.307 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -61.11 -18.29 57.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 177.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -57.99 -27.65 63.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.148 1.34 . . . . 0.0 113.25 174.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -113.15 21.07 15.7 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.699 1.599 . . . . 0.0 111.731 172.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.44 -8.74 12.32 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 126.549 2.023 . . . . 0.0 116.143 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.41 161.13 31.23 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.25 1.82 . . . . 0.0 113.078 -169.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.2 mt -99.71 152.56 19.95 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.133 0.973 . . . . 0.0 109.416 165.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -99.32 141.69 15.65 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 124.84 1.21 . . . . 0.0 112.138 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.47 139.76 40.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.153 1.381 . . . . 0.0 110.127 172.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.4 t -75.62 128.37 35.1 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.86 0.864 . . . . 0.0 110.798 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 16.6 mt -139.41 117.23 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.41 45.14 97.02 Favored Glycine 0 CA--C 1.533 1.207 0 O-C-N 121.875 -0.516 . . . . 0.0 113.257 178.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 60.44 10.59 2.54 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 115.651 1.723 . . . . 0.0 115.651 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.4 tt0 -124.95 120.77 32.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.765 1.226 . . . . 0.0 110.606 170.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.4 t -74.85 132.28 41.39 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 174.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -126.43 153.76 44.59 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.085 1.754 . . . . 0.0 109.842 175.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 34.0 m -80.89 161.27 24.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.457 0.703 . . . . 0.0 111.324 170.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.9 m -129.78 138.23 32.66 Favored Pre-proline 0 N--CA 1.481 1.116 0 O-C-N 121.572 -0.705 . . . . 0.0 110.682 -178.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -72.05 -9.59 24.79 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 123.818 3.012 . . . . 0.0 115.07 -168.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 75.1 m80 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.486 1.914 . . . . 0.0 115.875 -175.696 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -137.67 -153.5 0.49 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.0 1.32 . . . . 0.0 112.674 -169.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.3 m -69.89 123.63 21.97 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.617 1.567 . . . . 0.0 113.323 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -66.74 -49.2 66.75 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 124.275 1.988 . . . . 0.0 112.052 169.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 64.9 tp 61.58 -51.1 0.13 Allowed 'General case' 0 C--N 1.32 -0.688 1 C-N-CA 133.157 4.583 . . . . 0.0 113.052 -171.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 71.3 mtm180 -73.84 -36.27 64.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -174.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -83.01 -36.54 24.92 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.039 1.736 . . . . 0.0 111.446 168.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.2 t -52.27 -45.73 65.54 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.071 0.548 . . . . 0.0 112.073 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.24 -39.38 72.46 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.155 0.982 . . . . 0.0 113.206 173.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.49 -39.17 77.81 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.014 0.926 . . . . 0.0 112.34 176.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -66.81 -39.21 87.63 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.436 0.694 . . . . 0.0 111.54 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 71.6 m -65.39 -34.63 78.76 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.961 0.904 . . . . 0.0 113.241 171.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -61.5 -25.66 67.41 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.162 0.985 . . . . 0.0 112.924 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.1 m -64.44 -10.94 28.46 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 172.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -126.63 4.6 6.78 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.468 1.907 . . . . 0.0 112.33 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.56 28.59 69.16 Favored Glycine 0 CA--C 1.532 1.15 0 O-C-N 121.318 -0.864 . . . . 0.0 114.24 -173.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 18.7 mt -109.45 167.95 9.75 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.427 1.491 . . . . 0.0 111.425 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 mt -112.0 142.47 44.38 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 108.914 168.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -105.43 136.32 13.11 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.606 1.098 . . . . 0.0 112.756 -179.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -145.79 157.54 43.92 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.048 0.924 . . . . 0.0 112.533 170.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.1 t -81.73 123.29 28.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.7 0.8 . . . . 0.0 111.99 -177.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.1 mm -88.6 60.2 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.447 1.499 . . . . 0.0 109.206 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.84 -54.51 2.99 Favored Glycine 0 CA--C 1.532 1.128 0 C-N-CA 126.242 1.877 . . . . 0.0 113.831 -170.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -153.75 11.26 0.43 Allowed 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -174.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 61.9 tt0 -136.9 128.86 29.29 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.586 1.555 . . . . 0.0 107.953 168.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.8 t -81.71 150.73 27.85 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.171 -0.956 . . . . 0.0 111.772 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -150.26 135.52 17.96 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.002 0.521 . . . . 0.0 112.05 -173.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.3 m -82.11 155.41 25.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.861 0.864 . . . . 0.0 112.714 173.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.6 m -148.23 143.41 17.49 Favored Pre-proline 0 N--CA 1.478 0.937 0 C-N-CA 124.876 1.27 . . . . 0.0 111.365 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -77.66 -9.01 17.17 Favored 'Trans proline' 0 CA--C 1.536 0.603 0 C-N-CA 123.769 2.98 . . . . 0.0 115.333 -171.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 71.0 m80 . . . . . 0 C--O 1.249 1.074 0 C-N-CA 127.151 2.18 . . . . 0.0 113.999 -173.743 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -142.38 166.35 24.91 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.83 1.652 . . . . 0.0 111.082 176.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.4 m -71.63 149.79 45.26 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.5 m-80 -92.56 167.2 12.09 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.797 1.239 . . . . 0.0 108.493 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.93 -53.04 0.47 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.37 169.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.3 ptm180 -59.59 -56.82 17.05 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.124 0.875 . . . . 0.0 112.085 169.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -66.15 -37.96 86.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 119.688 1.131 . . . . 0.0 112.624 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.6 t -60.57 -49.4 77.7 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.027 0.931 . . . . 0.0 111.878 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -63.08 -40.68 98.37 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 117.641 -1.171 . . . . 0.0 112.299 176.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.73 -45.93 88.54 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.651 1.569 . . . . 0.0 111.731 176.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 68.6 m -64.47 -32.39 74.0 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 85.1 m -82.74 -47.51 11.88 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 175.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -62.09 -20.26 63.83 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.937 1.295 . . . . 0.0 112.057 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -62.59 -23.72 67.19 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 171.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.2 mt -110.06 14.18 23.03 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.619 1.568 . . . . 0.0 111.995 173.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.35 20.13 76.57 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.738 1.161 . . . . 0.0 114.383 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.2 mt -92.77 162.23 14.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.522 1.529 . . . . 0.0 111.317 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.1 mt -92.93 141.17 28.71 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.135 0.974 . . . . 0.0 108.781 167.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -106.3 132.34 11.08 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 124.808 1.194 . . . . 0.0 111.922 177.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.7 154.89 34.96 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.208 1.003 . . . . 0.0 112.849 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.5 t -91.18 132.17 36.26 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.536 1.134 . . . . 0.0 112.082 -174.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 68.7 mt -75.13 -37.25 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.759 0.823 . . . . 0.0 110.604 170.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 165.48 -38.07 0.27 Allowed Glycine 0 CA--C 1.534 1.226 0 C-N-CA 126.113 1.816 . . . . 0.0 111.839 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -148.82 7.53 0.74 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.064 2.145 . . . . 0.0 113.278 169.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -125.62 132.65 52.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.409 1.883 . . . . 0.0 111.325 173.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 9.6 t -74.06 141.42 45.73 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.437 1.095 . . . . 0.0 111.97 172.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -131.03 141.35 50.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 127.095 2.158 . . . . 0.0 111.105 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.1 m -103.87 153.7 20.46 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.077 0.951 . . . . 0.0 112.003 169.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.9 m -148.4 144.5 18.7 Favored Pre-proline 0 N--CA 1.484 1.229 0 C-N-CA 124.428 1.091 . . . . 0.0 112.174 176.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -87.88 -14.57 3.5 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.722 2.948 . . . . 0.0 114.187 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 C--O 1.252 1.212 0 C-N-CA 126.562 1.945 . . . . 0.0 116.192 -168.562 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -145.15 145.32 31.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.286 1.435 . . . . 0.0 112.297 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -70.13 151.13 45.79 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.996 1.11 . . . . 0.0 113.996 176.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -93.83 178.93 5.51 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 162.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.78 -66.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 167.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.5 tpp85 -59.46 -49.05 79.3 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.067 0.849 . . . . 0.0 112.287 177.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -62.13 -35.21 78.06 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.057 0.943 . . . . 0.0 112.299 177.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.5 t -71.09 -50.54 32.61 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.221 1.408 . . . . 0.0 111.321 178.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -58.79 -37.19 75.77 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.864 1.666 . . . . 0.0 112.54 176.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.8 mt -68.09 -40.34 82.68 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.775 1.23 . . . . 0.0 112.811 174.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.8 t -58.42 -46.77 85.82 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 169.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 78.2 m -68.97 -31.43 70.29 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -56.61 -33.73 66.54 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 124.801 1.24 . . . . 0.0 111.731 174.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.5 m -68.9 -3.15 11.59 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.8 mt -125.18 7.01 7.84 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 120.127 1.331 . . . . 0.0 111.769 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.9 27.76 71.73 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.799 1.19 . . . . 0.0 113.956 -173.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 16.2 mt -110.15 161.61 15.4 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 126.049 1.74 . . . . 0.0 112.076 -178.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -96.96 148.91 22.49 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.579 1.151 . . . . 0.0 108.9 166.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -96.48 140.95 15.34 Favored Glycine 0 CA--C 1.532 1.125 0 C-N-CA 125.189 1.376 . . . . 0.0 112.126 174.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -136.12 134.56 38.46 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.961 1.704 . . . . 0.0 111.06 -178.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.5 t -76.89 137.88 39.4 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.188 0.595 . . . . 0.0 112.306 173.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 19.4 mt -121.72 75.74 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 125.493 1.517 . . . . 0.0 108.853 172.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.35 -55.11 2.81 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.306 1.908 . . . . 0.0 114.526 175.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -146.91 -0.83 0.7 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.932 1.293 . . . . 0.0 114.326 -174.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -142.86 134.33 26.33 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.302 1.041 . . . . 0.0 110.776 173.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.8 t -97.13 138.77 34.13 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.007 0.923 . . . . 0.0 112.29 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -137.66 162.85 32.74 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 126.388 1.875 . . . . 0.0 112.066 179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 25.5 m -80.32 161.83 24.86 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.0 m -140.64 143.43 32.41 Favored Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 123.404 0.682 . . . . 0.0 112.064 -176.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.63 -1.79 11.79 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 123.883 3.056 . . . . 0.0 114.529 -172.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.9 m80 . . . . . 0 C--O 1.248 1.001 0 C-N-CA 125.158 1.383 . . . . 0.0 113.696 -169.525 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -72.45 88.46 1.21 Allowed 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.853 -1.154 . . . . 0.0 111.614 178.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.8 t -81.43 54.51 2.35 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.801 2.04 . . . . 0.0 111.831 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -72.68 163.71 27.65 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.873 -1.142 . . . . 0.0 110.445 169.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -134.29 -71.33 0.5 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.254 1.021 . . . . 0.0 109.432 174.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.7 ttp85 -55.17 -38.63 68.56 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.835 1.254 . . . . 0.0 112.919 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -86.75 -30.12 21.84 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.26 1.424 . . . . 0.0 113.817 175.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.6 t -62.78 -37.32 86.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 122.79 0.436 . . . . 0.0 111.424 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -52.1 -32.13 33.72 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 170.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.1 mt -78.25 -26.99 47.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.712 1.205 . . . . 0.0 112.337 -178.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.1 m -74.86 -41.94 58.87 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.546 0.738 . . . . 0.0 110.581 168.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.3 m -68.51 -23.46 64.55 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.399 1.079 . . . . 0.0 113.195 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -52.5 -26.11 12.1 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.311 1.844 . . . . 0.0 113.536 174.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 t -53.86 -34.33 59.01 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.3 mt -119.91 21.98 11.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.722 1.609 . . . . 0.0 112.157 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.09 23.95 71.56 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 123.972 0.796 . . . . 0.0 114.557 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 18.0 mt -94.01 163.93 13.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.131 1.372 . . . . 0.0 110.702 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -105.69 159.98 15.57 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.389 1.076 . . . . 0.0 108.398 166.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.57 138.47 13.94 Favored Glycine 0 CA--C 1.528 0.858 0 CA-C-O 118.622 -1.099 . . . . 0.0 111.671 177.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -137.29 135.58 37.25 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.827 2.051 . . . . 0.0 109.302 175.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.1 t -82.59 136.02 34.92 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.153 -0.967 . . . . 0.0 111.287 173.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.6 mt -120.72 100.46 9.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 124.883 1.273 . . . . 0.0 108.58 175.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.87 -66.98 2.4 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 127.222 2.344 . . . . 0.0 112.112 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -159.2 16.97 0.17 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.331 1.452 . . . . 0.0 112.974 -170.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -149.28 133.54 17.38 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.918 1.287 . . . . 0.0 110.315 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -84.04 133.28 34.67 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -118.35 156.67 28.53 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 127.994 2.518 . . . . 0.0 109.787 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 78.9 m -95.29 156.67 16.22 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.478 0.711 . . . . 0.0 112.442 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.2 m -142.0 140.89 20.33 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -85.97 70.55 4.58 Favored 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.755 4.304 . . . . 0.0 110.939 176.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.6 p80 . . . . . 0 C--O 1.25 1.111 0 C-N-CA 129.51 3.124 . . . . 0.0 117.491 -173.822 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 110.213 -0.291 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -142.26 131.14 22.94 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.736 0.814 . . . . 0.0 112.176 178.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 56.2 m -76.29 115.85 16.41 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.056 1.742 . . . . 0.0 113.457 -178.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -76.6 172.75 12.51 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.457 -0.777 . . . . 0.0 109.387 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.17 -59.51 1.04 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.423 168.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -62.29 -51.71 66.59 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.877 1.217 . . . . 0.0 112.07 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -65.0 -28.98 69.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.4 0.68 . . . . 0.0 112.068 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.3 t -68.06 -49.36 61.83 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 117.878 0.308 . . . . 0.0 111.114 174.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.85 -37.88 83.61 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.124 1.369 . . . . 0.0 112.545 174.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.07 -39.78 94.82 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.962 0.905 . . . . 0.0 112.471 172.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.9 m -68.95 -46.53 67.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.09 0.556 . . . . 0.0 111.583 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 85.5 m -62.72 -19.2 63.7 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.729 1.212 . . . . 0.0 114.051 176.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -55.56 -21.81 18.88 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.385 1.074 . . . . 0.0 112.522 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -56.12 -22.34 27.73 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.724 1.21 . . . . 0.0 114.003 173.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.9 mt -120.4 10.73 11.28 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.537 1.535 . . . . 0.0 112.881 170.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.88 24.87 76.65 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 124.674 1.131 . . . . 0.0 113.839 -173.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 31.7 mt -97.84 168.59 10.22 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.985 1.314 . . . . 0.0 111.55 -177.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -106.24 171.95 7.07 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 164.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -135.72 138.45 9.95 Favored Glycine 0 N--CA 1.468 0.831 0 C-N-CA 123.902 0.763 . . . . 0.0 113.213 -168.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -142.16 144.9 33.66 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.744 1.617 . . . . 0.0 111.661 -173.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.64 157.05 34.23 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.651 1.58 . . . . 0.0 114.222 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 15.5 mt -140.35 78.72 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 128.168 2.587 . . . . 0.0 107.243 168.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.14 -56.08 0.42 Allowed Glycine 0 CA--C 1.536 1.397 0 C-N-CA 128.442 2.925 . . . . 0.0 115.086 -177.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -145.3 -8.28 0.6 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.716 2.006 . . . . 0.0 114.638 -176.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -111.76 129.34 56.16 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.331 1.452 . . . . 0.0 109.897 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.9 t -99.42 127.37 45.45 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.507 1.049 . . . . 0.0 111.922 174.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.4 mttt -131.2 145.08 51.79 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.078 1.751 . . . . 0.0 112.23 -169.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.6 m -84.33 159.79 20.83 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -169.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.53 142.86 24.41 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 124.223 1.009 . . . . 0.0 113.404 -174.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -77.89 -4.1 14.14 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 124.667 3.578 . . . . 0.0 113.193 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.9 m80 . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.236 1.815 . . . . 0.0 114.097 -175.664 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.796 0 N-CA-C 111.275 0.102 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -46.41 130.05 10.77 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.942 2.097 . . . . 0.0 115.12 -173.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.3 t -88.62 122.12 31.72 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.243 1.017 . . . . 0.0 108.972 169.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -87.91 155.01 20.07 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.25 -0.907 . . . . 0.0 111.958 -174.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.61 -64.71 0.74 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.782 0.833 . . . . 0.0 109.439 174.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -59.78 -36.06 75.91 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -81.29 -35.1 31.48 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 119.306 0.957 . . . . 0.0 113.202 169.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.9 t -64.25 -42.83 96.33 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -56.21 -32.67 64.62 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 120.819 -1.175 . . . . 0.0 112.264 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 69.5 mt -73.69 -29.24 62.17 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.872 1.269 . . . . 0.0 113.435 175.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.2 t -69.92 -47.84 60.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.29 0.636 . . . . 0.0 110.578 169.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.443 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 76.6 m -59.62 -35.38 74.23 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.63 -0.669 . . . . 0.0 112.668 177.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -56.12 -23.18 32.7 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.149 1.38 . . . . 0.0 113.546 174.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.4 t -59.79 -28.25 67.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.302 1.041 . . . . 0.0 113.581 172.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.0 mt -113.44 18.75 17.48 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.035 1.734 . . . . 0.0 111.089 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.67 5.52 24.54 Favored Glycine 0 CA--C 1.538 1.517 0 C-N-CA 126.995 2.236 . . . . 0.0 115.349 -173.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.443 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 32.8 mt -75.31 165.63 24.87 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.178 1.791 . . . . 0.0 113.042 -173.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 tp -98.57 160.43 14.28 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.814 2.046 . . . . 0.0 108.806 168.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -130.64 145.05 16.46 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-N 120.272 1.396 . . . . 0.0 114.658 -178.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.46 147.36 32.11 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 126.422 1.889 . . . . 0.0 112.063 175.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.7 t -81.85 120.01 24.65 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 118.278 0.49 . . . . 0.0 112.065 176.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 33.3 mm -89.07 -63.64 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 O-C-N 121.579 -0.701 . . . . 0.0 111.449 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -151.52 73.83 0.27 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 125.236 1.398 . . . . 0.0 110.446 -178.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 61.18 22.06 12.42 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.954 1.701 . . . . 0.0 113.735 -173.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -148.87 129.22 13.8 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 125.891 1.676 . . . . 0.0 110.381 169.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 35.2 t -76.01 129.2 36.51 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.795 1.238 . . . . 0.0 112.342 175.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -106.09 137.68 43.59 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 126.648 1.979 . . . . 0.0 109.489 175.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.0 m -87.34 147.23 25.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 120.974 0.416 . . . . 0.0 112.038 169.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.3 m -141.64 142.22 25.15 Favored Pre-proline 0 N--CA 1.473 0.683 0 C-N-CA 124.281 1.032 . . . . 0.0 112.775 -168.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -83.56 9.39 4.12 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 124.644 3.563 . . . . 0.0 114.504 -171.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 49.5 m80 . . . . . 0 C--O 1.25 1.085 0 C-N-CA 126.157 1.783 . . . . 0.0 114.23 179.305 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.629 0 CA-C-O 119.962 -0.066 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -78.37 157.63 29.03 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.93 0.892 . . . . 0.0 111.495 171.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.8 t -60.91 130.13 44.91 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.19 0.596 . . . . 0.0 112.048 175.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -94.06 159.31 15.22 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.241 -0.912 . . . . 0.0 110.85 169.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -127.82 -66.13 0.88 Allowed 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.873 1.269 . . . . 0.0 108.624 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -62.73 -37.64 87.35 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.697 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -80.74 -33.01 35.43 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.987 0.812 . . . . 0.0 112.353 171.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.1 t -61.45 -42.32 98.58 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.825 0.739 . . . . 0.0 112.328 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -57.57 -22.29 43.94 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.755 -1.216 . . . . 0.0 113.813 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 81.1 mt -63.84 -24.97 67.96 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.539 1.063 . . . . 0.0 113.545 175.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 t -82.5 -44.66 15.68 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.949 -0.469 . . . . 0.0 111.175 169.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.45 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 79.6 m -67.6 -43.93 79.33 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -65.9 -18.25 65.21 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.115 0.966 . . . . 0.0 113.169 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.3 t -65.28 -24.12 67.22 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.463 0.705 . . . . 0.0 112.564 171.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -107.81 12.9 26.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.914 1.686 . . . . 0.0 111.904 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.57 22.56 77.91 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 125.294 1.426 . . . . 0.0 114.761 -176.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.45 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 27.8 mt -96.61 171.56 8.46 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.228 1.411 . . . . 0.0 112.701 -174.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.8 tp -108.3 147.28 31.68 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.198 2.599 . . . . 0.0 108.685 168.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.89 130.2 10.15 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.445 1.022 . . . . 0.0 113.057 173.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -140.0 149.44 43.23 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.28 1.832 . . . . 0.0 111.751 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.5 m -78.95 116.53 19.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.735 0.814 . . . . 0.0 111.875 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 7.8 tt -83.53 -11.25 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 125.732 1.613 . . . . 0.0 114.646 -172.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 175.3 -48.89 0.13 Allowed Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.944 1.735 . . . . 0.0 111.579 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -154.99 14.57 0.4 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 126.655 1.982 . . . . 0.0 112.566 168.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -142.05 146.9 36.0 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 126.237 1.815 . . . . 0.0 111.386 -175.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 34.9 t -86.37 127.0 34.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.69 0.677 . . . . 0.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -132.37 150.19 52.21 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.855 0.862 . . . . 0.0 112.777 172.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 60.6 m -87.77 149.11 24.39 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -169.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 m -146.28 144.07 20.51 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.127 1.371 . . . . 0.0 112.777 -174.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -88.76 0.69 6.35 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 124.304 3.336 . . . . 0.0 115.914 -170.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 70.1 m80 . . . . . 0 C--O 1.256 1.404 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -171.706 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -70.96 -178.61 1.98 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.373 1.469 . . . . 0.0 113.032 -173.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.2 t -71.1 45.43 0.09 Allowed 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 126.242 1.817 . . . . 0.0 115.273 -172.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.07 171.27 14.41 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 120.472 -1.392 . . . . 0.0 112.578 174.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.2 tt -139.69 -59.52 0.56 Allowed 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.312 1.045 . . . . 0.0 109.929 169.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.53 -23.36 66.86 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -177.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -93.64 -36.24 12.46 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.353 1.061 . . . . 0.0 112.514 169.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -67.49 -37.38 82.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.658 0.783 . . . . 0.0 113.084 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.87 -31.89 65.28 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 120.996 -1.065 . . . . 0.0 112.235 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 mt -64.79 -42.13 95.28 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.359 1.064 . . . . 0.0 112.895 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.8 p -78.09 -35.41 49.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.988 1.315 . . . . 0.0 112.416 178.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.1 m -70.48 -44.8 66.96 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 172.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.9 mtt-85 -65.13 -21.89 66.85 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.595 -1.315 . . . . 0.0 112.894 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.6 m -61.46 -19.04 61.57 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 169.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.7 mt -112.18 13.62 20.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 126.406 1.882 . . . . 0.0 112.492 175.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.29 24.76 67.62 Favored Glycine 0 CA--C 1.54 1.621 0 C-N-CA 124.151 0.881 . . . . 0.0 115.266 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.1 mt -111.13 -179.15 3.65 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.457 2.303 . . . . 0.0 111.748 -174.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.8 mt -107.42 163.42 13.06 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.539 1.535 . . . . 0.0 107.96 161.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.92 132.03 9.63 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.53 1.538 . . . . 0.0 111.824 174.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -145.04 139.68 27.59 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.739 1.615 . . . . 0.0 111.285 -175.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.8 t -76.75 138.36 39.88 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.393 -0.817 . . . . 0.0 112.297 175.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.9 mm -82.39 -57.34 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 125.329 1.452 . . . . 0.0 110.728 170.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.04 -41.02 0.04 OUTLIER Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.158 0.885 . . . . 0.0 113.797 178.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -132.06 0.97 3.86 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.498 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -140.08 154.13 46.96 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.396 2.278 . . . . 0.0 110.296 -179.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.1 t -110.87 137.31 48.67 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.54 0.736 . . . . 0.0 111.823 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -141.15 163.51 32.78 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.971 1.708 . . . . 0.0 110.627 -170.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.9 m -101.11 158.34 16.09 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -168.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -149.52 147.3 22.69 Favored Pre-proline 0 N--CA 1.483 1.189 0 C-N-CA 124.1 0.96 . . . . 0.0 113.466 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -84.22 63.24 6.84 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 125.297 3.998 . . . . 0.0 112.265 172.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 72.0 m80 . . . . . 0 C--O 1.252 1.224 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 172.802 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.035 0 CA-C-O 118.985 -0.531 . . . . 0.0 112.137 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -149.64 145.22 26.63 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 125.932 1.693 . . . . 0.0 113.284 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.5 m -87.38 120.65 28.89 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.75 1.62 . . . . 0.0 113.867 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -78.36 174.57 11.12 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 121.431 -0.793 . . . . 0.0 110.938 167.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.8 tt -142.62 -63.76 0.42 Allowed 'General case' 0 N--CA 1.47 0.553 0 O-C-N 121.698 -0.626 . . . . 0.0 110.252 168.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.13 -39.15 81.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.055 0.942 . . . . 0.0 112.025 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 73.9 mtt-85 -78.71 -33.08 47.1 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.99 1.268 . . . . 0.0 112.837 172.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.1 t -67.49 -40.82 85.26 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.863 0.865 . . . . 0.0 112.441 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -60.23 -42.11 94.55 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.783 -1.198 . . . . 0.0 112.275 175.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 75.6 mt -66.89 -41.49 87.12 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.243 1.017 . . . . 0.0 112.074 174.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.8 t -63.25 -45.31 92.14 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.466 1.107 . . . . 0.0 112.199 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -70.2 -31.53 69.03 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -63.67 -24.04 67.62 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.936 -1.103 . . . . 0.0 112.414 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -66.55 1.57 1.66 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 170.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -128.16 4.14 5.82 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.657 1.983 . . . . 0.0 111.48 167.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.11 31.41 38.83 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 126.382 1.944 . . . . 0.0 114.402 -175.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -121.68 159.79 25.83 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.907 1.353 . . . . 0.0 112.6 -170.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.4 tp -87.39 148.64 24.92 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.016 1.727 . . . . 0.0 109.341 168.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -108.36 128.59 9.17 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.584 1.088 . . . . 0.0 113.411 175.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt -141.99 143.15 33.06 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 127.563 2.345 . . . . 0.0 112.147 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.6 t -72.55 146.85 46.46 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.374 1.069 . . . . 0.0 113.137 174.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.3 pt -123.16 10.36 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 125.436 1.494 . . . . 0.0 114.37 171.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.15 -58.42 0.51 Allowed Glycine 0 CA--C 1.53 0.984 0 C-N-CA 125.373 1.463 . . . . 0.0 112.157 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -142.09 -0.11 1.32 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.85 1.26 . . . . 0.0 113.298 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -125.33 135.35 52.37 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.891 1.677 . . . . 0.0 109.774 170.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.7 t -90.29 117.29 28.92 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.956 -0.465 . . . . 0.0 110.05 168.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -102.59 165.85 10.85 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.869 1.268 . . . . 0.0 112.02 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -102.54 148.44 25.53 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.599 0.963 . . . . 0.0 113.599 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.5 m -150.75 152.94 33.05 Favored Pre-proline 0 N--CA 1.478 0.966 0 C-N-CA 124.971 1.308 . . . . 0.0 112.417 -173.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -77.19 68.42 7.41 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.704 3.602 . . . . 0.0 110.424 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.9 m80 . . . . . 0 C--O 1.248 1.014 0 C-N-CA 128.626 2.77 . . . . 0.0 114.072 169.793 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.8 0 CA-C-O 119.346 -0.359 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -126.28 141.78 51.78 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.389 1.475 . . . . 0.0 110.826 172.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.5 t -91.13 116.94 29.2 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.907 1.283 . . . . 0.0 111.646 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -86.48 165.77 16.02 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.51 1.05 . . . . 0.0 111.958 173.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -133.55 -62.64 0.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 124.949 1.3 . . . . 0.0 108.363 169.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 79.1 mtp85 -61.59 -38.08 86.25 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -88.86 -20.91 24.01 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.53 1.308 . . . . 0.0 114.53 169.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.3 t -63.83 -42.17 97.68 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.159 0.891 . . . . 0.0 111.389 173.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -50.03 -42.01 48.6 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.479 1.112 . . . . 0.0 112.769 176.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.67 -30.39 70.7 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.672 1.189 . . . . 0.0 112.59 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -73.17 -48.47 35.04 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.937 0.895 . . . . 0.0 111.742 171.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.436 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.9 m -60.68 -31.5 70.75 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -62.43 -17.78 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.746 1.218 . . . . 0.0 114.162 175.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.3 p -57.53 -24.7 57.52 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.82 1.191 . . . . 0.0 114.03 170.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 77.7 mt -124.09 16.5 9.21 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.52 1.928 . . . . 0.0 112.044 175.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.49 25.6 70.21 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 124.362 0.982 . . . . 0.0 114.801 -177.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.436 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 27.4 mt -86.65 169.23 12.89 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.308 1.443 . . . . 0.0 111.763 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -98.88 140.77 32.55 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.924 2.49 . . . . 0.0 108.412 168.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.08 136.57 12.76 Favored Glycine 0 CA--C 1.532 1.153 0 C-N-CA 124.424 1.011 . . . . 0.0 113.654 177.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -141.78 138.99 32.67 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.925 1.69 . . . . 0.0 112.277 177.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.8 t -77.36 133.86 38.62 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.709 0.804 . . . . 0.0 112.521 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.4 mm -86.35 -37.73 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.827 0.851 . . . . 0.0 112.011 173.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 170.55 -53.13 0.19 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.716 1.151 . . . . 0.0 112.829 175.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -123.24 -3.31 8.48 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.416 1.886 . . . . 0.0 112.921 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -150.04 144.63 25.9 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.322 1.849 . . . . 0.0 111.099 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.9 t -91.34 145.95 24.22 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.014 0.925 . . . . 0.0 113.439 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.5 tptt -128.78 132.36 47.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.304 2.642 . . . . 0.0 109.596 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.3 m -83.1 157.61 22.76 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.676 0.79 . . . . 0.0 113.094 176.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.1 m -149.9 147.59 22.9 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 125.839 1.655 . . . . 0.0 111.034 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -90.16 25.62 0.55 Allowed 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 123.765 2.976 . . . . 0.0 115.205 -169.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 . . . . . 0 C--O 1.253 1.253 0 CA-C-O 116.999 -1.477 . . . . 0.0 113.846 -179.009 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.687 0 CA-C-O 120.729 0.299 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -87.51 36.55 0.75 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.195 1.398 . . . . 0.0 113.365 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -89.43 165.66 14.2 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.358 1.463 . . . . 0.0 114.294 -171.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -129.28 164.38 23.62 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.064 1.746 . . . . 0.0 110.662 169.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.6 tp -136.06 -61.34 0.71 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.152 0.981 . . . . 0.0 111.187 173.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 19.6 ttm-85 -61.18 -42.04 97.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.759 0.824 . . . . 0.0 112.26 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 15.7 tpp180 -68.42 -44.71 74.41 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.618 1.567 . . . . 0.0 111.866 168.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -55.36 -40.26 71.06 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.815 0.846 . . . . 0.0 112.377 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -61.26 -36.82 81.06 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.694 -1.254 . . . . 0.0 114.06 173.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 71.3 mt -71.03 -36.12 72.25 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.606 0.762 . . . . 0.0 111.846 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.3 m -65.9 -27.24 68.05 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.465 1.106 . . . . 0.0 113.124 173.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.8 m -82.44 -12.53 57.8 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.0 mtm180 -53.73 -23.56 12.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.803 0.841 . . . . 0.0 112.655 167.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 99.0 p -41.85 -37.06 1.18 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.851 2.06 . . . . 0.0 114.915 172.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.0 mt -133.35 19.07 3.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.708 2.003 . . . . 0.0 111.491 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.21 16.87 77.1 Favored Glycine 0 CA--C 1.537 1.435 0 C-N-CA 125.204 1.383 . . . . 0.0 115.178 -178.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.5 mt -94.43 166.93 11.82 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.653 1.581 . . . . 0.0 112.939 -170.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 mt -90.02 160.75 16.19 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.793 -1.094 . . . . 0.0 108.96 165.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -114.57 144.13 18.26 Favored Glycine 0 N--CA 1.471 0.979 0 C-N-CA 124.391 0.995 . . . . 0.0 112.701 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -140.99 151.76 44.38 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.226 1.81 . . . . 0.0 110.892 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 t -91.24 113.82 26.18 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 168.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.0 mt -129.7 104.77 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -174.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.49 54.85 17.43 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.124 0.868 . . . . 0.0 113.122 -175.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 60.37 18.42 8.07 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.962 1.705 . . . . 0.0 114.92 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -144.37 143.42 30.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.879 1.672 . . . . 0.0 112.409 176.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.9 t -70.67 137.7 50.04 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.807 1.243 . . . . 0.0 110.989 178.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -157.03 161.2 39.53 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.94 1.296 . . . . 0.0 111.764 168.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 63.5 m -94.33 159.92 14.91 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -169.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.1 m -147.79 148.92 31.89 Favored Pre-proline 0 N--CA 1.478 0.928 0 N-CA-C 114.063 1.135 . . . . 0.0 114.063 -168.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -82.67 60.08 7.08 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 125.255 3.97 . . . . 0.0 112.648 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.1 m80 . . . . . 0 C--O 1.248 1.018 0 C-N-CA 127.735 2.414 . . . . 0.0 115.181 171.634 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 110.564 -0.161 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -72.11 156.6 39.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.911 1.284 . . . . 0.0 113.303 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.0 t -62.15 166.51 4.75 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.894 2.077 . . . . 0.0 114.342 -173.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -135.51 160.8 37.34 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.386 1.474 . . . . 0.0 110.095 168.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 17.6 tp -131.06 -67.87 0.69 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.91 0.884 . . . . 0.0 109.497 174.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -43.42 87.66 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.173 -0.918 . . . . 0.0 113.263 177.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.3 mtp180 -70.8 -40.61 72.42 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 118.863 0.756 . . . . 0.0 112.364 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.99 -44.35 87.12 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 117.695 0.225 . . . . 0.0 110.964 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -57.75 -33.61 68.66 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.982 1.313 . . . . 0.0 114.388 176.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 93.8 mt -70.92 -45.27 64.52 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 119.163 0.892 . . . . 0.0 111.497 177.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -62.17 -37.09 83.92 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.821 0.448 . . . . 0.0 111.632 171.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 76.4 m -67.26 -32.38 73.36 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 172.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -61.67 -25.87 67.66 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.817 -1.177 . . . . 0.0 112.42 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.3 m -61.85 -15.62 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 174.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -120.18 8.22 10.89 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.7 1.6 . . . . 0.0 112.038 173.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.16 36.82 90.76 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.997 1.284 . . . . 0.0 113.755 -173.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 17.4 mt -109.24 159.93 16.53 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.663 1.185 . . . . 0.0 112.231 -177.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -89.77 150.12 22.42 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.864 2.065 . . . . 0.0 108.314 167.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.12 130.37 8.36 Favored Glycine 0 N--CA 1.472 1.059 0 CA-C-N 119.233 0.924 . . . . 0.0 111.763 174.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -134.67 147.2 50.08 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.786 1.634 . . . . 0.0 111.893 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 6.8 t -85.89 132.74 34.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 122.983 0.513 . . . . 0.0 111.2 178.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.3 pt -134.2 1.71 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -168.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 166.18 45.01 0.02 OUTLIER Glycine 0 N--CA 1.473 1.146 0 CA-C-N 119.484 1.038 . . . . 0.0 114.404 -173.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 62.02 25.11 15.03 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.008 1.323 . . . . 0.0 112.298 -169.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -158.32 147.56 19.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 128.202 2.601 . . . . 0.0 109.483 178.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.0 t -101.56 142.49 32.85 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 124.533 1.133 . . . . 0.0 111.813 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.0 ttmt -127.85 134.17 49.4 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.821 1.248 . . . . 0.0 110.266 172.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.37 156.6 39.1 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 174.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.2 m -151.57 146.47 18.88 Favored Pre-proline 0 N--CA 1.478 0.963 0 C-N-CA 125.102 1.361 . . . . 0.0 111.646 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -81.08 62.68 8.6 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.867 3.045 . . . . 0.0 111.411 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.0 m80 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 127.94 2.496 . . . . 0.0 114.213 179.67 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -119.76 123.69 44.34 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.688 1.195 . . . . 0.0 110.899 177.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -89.68 115.08 26.79 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.301 1.04 . . . . 0.0 111.316 -169.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -92.35 166.51 12.54 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.737 -0.602 . . . . 0.0 109.938 167.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tt -130.38 -68.46 0.69 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 118.498 -0.763 . . . . 0.0 109.932 175.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -63.83 -47.3 81.33 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.934 1.243 . . . . 0.0 112.296 178.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -63.54 -38.2 90.21 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.563 0.62 . . . . 0.0 111.229 174.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.5 t -59.06 -46.01 89.33 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 172.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -58.61 -38.64 78.44 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.679 -1.263 . . . . 0.0 112.343 175.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.4 mt -71.72 -29.91 65.06 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.7 m -71.32 -39.53 71.33 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.901 0.881 . . . . 0.0 111.621 172.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 72.9 m -69.98 -27.98 65.16 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.709 1.204 . . . . 0.0 112.606 173.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 48.8 ttp85 -54.31 -32.48 56.65 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.925 1.29 . . . . 0.0 112.191 176.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.6 m -64.28 -7.19 8.58 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 115.4 1.63 . . . . 0.0 115.4 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.0 mt -127.64 19.77 6.69 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.507 1.503 . . . . 0.0 111.723 169.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.88 20.7 70.8 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.203 0.906 . . . . 0.0 114.169 -175.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 31.4 mt -99.55 158.62 15.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.92 1.688 . . . . 0.0 111.662 -176.231 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -97.66 155.72 16.86 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.232 2.213 . . . . 0.0 109.157 169.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -115.53 125.61 6.77 Favored Glycine 0 N--CA 1.473 1.15 0 C-N-CA 124.231 0.92 . . . . 0.0 113.379 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -119.46 117.79 29.38 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.834 1.654 . . . . 0.0 111.129 179.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.0 t -73.25 122.03 21.3 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.804 -0.56 . . . . 0.0 110.428 172.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.0 mm -87.33 -35.48 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.158 0.89 . . . . 0.0 112.407 -174.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 171.79 -32.91 0.13 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.593 1.092 . . . . 0.0 114.925 173.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -138.32 -19.53 1.1 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 127.329 2.252 . . . . 0.0 111.908 173.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -134.64 148.49 50.39 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.226 1.811 . . . . 0.0 111.423 174.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 36.6 t -101.03 143.31 31.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.787 1.235 . . . . 0.0 112.93 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -119.87 141.77 49.26 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 127.223 2.209 . . . . 0.0 110.583 -175.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -91.14 152.31 20.63 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 171.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 m -153.65 153.89 29.57 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.501 1.52 . . . . 0.0 111.202 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.58 -17.8 26.17 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 121.832 1.688 . . . . 0.0 112.089 169.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 . . . . . 0 C--O 1.248 0.98 0 C-N-CA 127.064 2.146 . . . . 0.0 114.912 -174.837 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.475 0.178 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -113.43 153.6 28.35 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.33 1.452 . . . . 0.0 112.909 -174.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.1 t -66.55 134.61 52.74 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.746 1.618 . . . . 0.0 113.175 -175.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -93.33 159.64 15.17 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.256 1.022 . . . . 0.0 109.811 168.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -137.49 -65.24 0.53 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.341 0.656 . . . . 0.0 110.428 172.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.78 -23.78 66.42 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 177.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -89.1 -41.21 12.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.054 1.742 . . . . 0.0 111.99 169.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.3 t -58.93 -42.19 89.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.233 1.013 . . . . 0.0 112.159 -179.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -56.95 -32.43 66.0 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.993 1.317 . . . . 0.0 114.111 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.0 mt -71.72 -40.27 69.57 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.632 -0.667 . . . . 0.0 111.732 -173.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.5 t -73.83 -30.81 62.9 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 172.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.0 m -63.27 -36.68 84.48 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.088 -1.007 . . . . 0.0 113.13 172.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -59.07 -30.96 68.45 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 121.228 -0.92 . . . . 0.0 112.982 175.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -66.74 -14.3 62.4 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 177.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -114.79 6.62 15.58 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.53 1.532 . . . . 0.0 112.146 170.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.04 36.55 40.65 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 125.285 1.422 . . . . 0.0 114.609 178.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -123.34 160.78 26.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.595 1.558 . . . . 0.0 112.104 -169.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.6 mt -86.03 152.9 22.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.847 0.859 . . . . 0.0 108.728 165.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -102.56 128.94 9.71 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.855 0.741 . . . . 0.0 111.36 170.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -142.37 134.18 27.01 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.536 1.534 . . . . 0.0 111.653 -176.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 12.2 t -75.06 151.75 38.66 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 -176.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.5 mt -97.98 -44.56 12.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.481 1.912 . . . . 0.0 109.689 169.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 168.69 -56.65 0.21 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.095 1.807 . . . . 0.0 110.905 177.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -126.71 11.12 7.22 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.371 1.468 . . . . 0.0 113.313 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -137.47 150.13 47.35 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 128.06 2.544 . . . . 0.0 109.887 168.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 39.2 t -105.38 147.28 28.38 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 123.778 0.831 . . . . 0.0 111.061 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -128.91 140.36 51.71 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.062 1.745 . . . . 0.0 111.038 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.2 m -88.86 146.79 24.74 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.246 0.618 . . . . 0.0 112.205 169.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.9 m -141.42 143.51 30.35 Favored Pre-proline 0 N--CA 1.482 1.127 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -84.29 57.3 5.21 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.582 3.521 . . . . 0.0 112.636 179.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 82.1 m-70 . . . . . 0 C--O 1.254 1.334 0 C-N-CA 127.833 2.453 . . . . 0.0 115.204 171.27 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 119.569 -0.253 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -52.29 160.42 0.8 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.629 1.172 . . . . 0.0 113.794 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.0 t -73.6 45.36 0.18 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.43 1.492 . . . . 0.0 114.139 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -68.51 159.28 32.1 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.442 -0.786 . . . . 0.0 109.332 168.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -127.06 -76.25 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.202 1.401 . . . . 0.0 109.128 171.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -64.71 -33.3 75.63 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 117.916 -1.04 . . . . 0.0 112.573 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -77.13 -33.52 56.77 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.151 0.981 . . . . 0.0 112.707 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.3 t -61.87 -42.89 99.6 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 118.844 0.747 . . . . 0.0 111.675 175.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -54.76 -32.06 59.46 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.229 1.012 . . . . 0.0 113.485 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.4 mt -69.71 -30.55 68.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.046 0.939 . . . . 0.0 112.88 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 72.2 m -75.11 -41.68 58.07 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.623 0.769 . . . . 0.0 110.866 169.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.48 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.8 m -65.5 -23.43 66.89 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.514 1.125 . . . . 0.0 113.682 178.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -51.21 -28.13 10.65 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.647 1.979 . . . . 0.0 113.087 171.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.9 t -51.33 -34.71 34.81 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.663 1.585 . . . . 0.0 113.586 175.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.1 mt -122.18 19.59 10.69 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.105 1.362 . . . . 0.0 112.646 -177.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.2 24.67 74.74 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.246 0.926 . . . . 0.0 114.088 -178.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 16.5 mt -102.02 159.58 15.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.449 1.5 . . . . 0.0 112.101 -175.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.7 mt -93.5 173.4 7.72 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 164.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -132.29 139.0 10.57 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -139.54 137.38 35.39 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.397 1.079 . . . . 0.0 110.215 -174.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.0 t -84.17 142.55 30.25 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 176.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.0 mt -142.72 117.52 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.782 1.633 . . . . 0.0 107.78 173.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 59.77 44.97 96.52 Favored Glycine 0 CA--C 1.537 1.408 0 O-C-N 121.683 -0.635 . . . . 0.0 114.061 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 68.49 28.91 5.84 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -148.89 146.75 28.05 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.092 -1.63 . . . . 0.0 111.583 168.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -89.03 153.19 21.2 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 174.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -147.42 144.49 28.69 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 126.427 1.891 . . . . 0.0 110.362 172.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.6 m -83.85 153.43 24.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -155.75 143.35 14.01 Favored Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 125.45 1.5 . . . . 0.0 111.911 -177.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -81.76 -21.22 6.11 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.549 2.833 . . . . 0.0 114.52 -169.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 47.2 m-70 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 126.439 1.896 . . . . 0.0 114.026 -169.758 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -75.3 166.24 23.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 -170.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 43.3 t -74.96 59.21 0.9 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.608 1.563 . . . . 0.0 111.012 167.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -73.31 157.15 37.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.122 -0.986 . . . . 0.0 109.274 169.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -127.14 -72.09 0.65 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 117.879 -1.058 . . . . 0.0 110.988 171.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -62.01 -42.0 98.68 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 121.012 1.733 . . . . 0.0 112.922 173.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 61.3 mtt-85 -66.01 -35.95 81.96 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 118.757 0.708 . . . . 0.0 111.034 175.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.85 -42.42 97.57 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.103 0.961 . . . . 0.0 112.157 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.451 ' HG2' ' H ' ' A' ' 19' ' ' GLY . 88.2 mt-10 -59.48 -29.83 68.11 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.927 -1.108 . . . . 0.0 112.909 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -72.52 -42.12 65.12 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.044 0.838 . . . . 0.0 112.595 170.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 m -62.28 -39.54 93.26 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.429 0.692 . . . . 0.0 111.637 175.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 17' ' ' LEU . 74.0 m -70.73 -30.32 66.82 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.462 1.505 . . . . 0.0 113.405 175.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -57.0 -27.03 61.23 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.916 -1.115 . . . . 0.0 112.398 176.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.8 m -60.67 -17.84 50.07 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 175.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 98.8 mt -117.93 9.08 12.73 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.608 1.095 . . . . 0.0 112.914 170.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.13 18.39 74.62 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.73 1.157 . . . . 0.0 114.093 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 34.9 mt -95.06 176.51 6.21 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.06 1.744 . . . . 0.0 111.307 -178.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.03 168.76 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.691 1.996 . . . . 0.0 108.076 165.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.451 ' H ' ' HG2' ' A' ' 9' ' ' GLU . . . -116.62 149.22 18.81 Favored Glycine 0 N--CA 1.471 1.016 0 C-N-CA 124.165 0.888 . . . . 0.0 114.178 -172.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -138.38 133.95 33.54 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.297 1.839 . . . . 0.0 109.464 170.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.4 t -75.25 142.46 43.35 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.307 -0.871 . . . . 0.0 111.228 172.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.4 mm -93.86 -30.27 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.629 1.172 . . . . 0.0 111.689 175.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 162.08 -39.7 0.38 Allowed Glycine 0 N--CA 1.472 1.084 0 C-N-CA 125.709 1.624 . . . . 0.0 114.112 171.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -124.61 -10.21 7.35 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.398 1.479 . . . . 0.0 112.338 174.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -148.92 154.25 39.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.524 1.93 . . . . 0.0 110.9 -176.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 t -96.87 152.32 18.82 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.027 0.931 . . . . 0.0 113.056 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 59.5 mttm -130.59 143.78 50.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.537 1.535 . . . . 0.0 110.349 169.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -84.07 158.82 21.3 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 m -144.81 139.96 15.86 Favored Pre-proline 0 N--CA 1.476 0.827 0 C-N-CA 126.517 1.927 . . . . 0.0 110.739 -175.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -92.76 -24.22 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.741 2.961 . . . . 0.0 116.656 -168.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 C--O 1.253 1.282 0 C-N-CA 126.995 2.118 . . . . 0.0 113.201 -168.834 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 120.505 0.193 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -77.64 163.28 26.36 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.539 1.135 . . . . 0.0 111.245 168.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -67.01 162.48 21.99 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -178.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -126.98 174.33 8.94 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.056 1.343 . . . . 0.0 111.038 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.73 -73.57 0.43 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.31 1.044 . . . . 0.0 110.391 168.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.3 tpp85 -57.62 -45.74 85.01 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.365 1.438 . . . . 0.0 112.051 175.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.78 -28.42 67.59 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.382 -0.823 . . . . 0.0 113.037 176.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.4 t -67.95 -43.94 77.91 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.616 0.766 . . . . 0.0 111.586 169.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -60.37 -39.78 88.45 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.65 -1.281 . . . . 0.0 113.339 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.13 -40.98 91.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.18 0.592 . . . . 0.0 111.69 175.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 20.9 t -63.43 -39.14 93.69 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 173.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 90.3 m -69.0 -12.21 61.48 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.035 1.334 . . . . 0.0 114.597 178.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -54.32 -26.48 29.8 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 121.162 -0.961 . . . . 0.0 112.532 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.5 t -54.97 -38.32 67.64 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -176.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mp -116.72 20.01 14.21 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.364 1.465 . . . . 0.0 113.579 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.52 25.82 73.77 Favored Glycine 0 CA--C 1.539 1.545 0 O-C-N 120.92 -1.113 . . . . 0.0 115.029 178.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 25.8 mt -90.18 170.85 9.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.504 1.521 . . . . 0.0 111.353 -178.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 mt -113.11 152.63 29.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.255 1.422 . . . . 0.0 110.037 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -112.41 131.07 9.93 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.235 0.921 . . . . 0.0 113.682 -172.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -131.25 141.04 49.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.022 1.329 . . . . 0.0 111.86 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.57 125.82 32.18 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.346 1.058 . . . . 0.0 111.911 -177.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 61.3 mt -75.44 -47.25 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.626 1.17 . . . . 0.0 111.19 -177.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.44 -34.54 0.12 Allowed Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.613 1.578 . . . . 0.0 113.461 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -120.86 -26.02 5.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.629 1.972 . . . . 0.0 112.549 171.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -140.2 152.36 45.93 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.294 1.838 . . . . 0.0 111.983 -169.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.1 t -113.99 134.98 54.49 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.679 1.191 . . . . 0.0 112.853 -179.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -138.8 159.06 43.03 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.148 1.779 . . . . 0.0 112.604 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.6 m -80.49 162.69 24.24 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -171.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -143.47 142.34 20.95 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.48 1.512 . . . . 0.0 112.318 178.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -81.15 -12.22 11.83 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 124.054 3.169 . . . . 0.0 115.076 -174.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 . . . . . 0 C--O 1.258 1.519 0 CA-C-O 116.71 -1.614 . . . . 0.0 113.446 176.602 . . . . . . . . 0 0 . 1 stop_ save_