data_2mm8_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2mm8 _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.085 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -72.65 15.91 0.17 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.658 1.583 . . . . 0.0 114.584 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -144.09 -11.49 0.65 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.431 -1.418 . . . . 0.0 113.586 178.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -54.05 -39.44 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 125.14 1.376 . . . . 0.0 112.62 -173.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.8 p -146.23 -61.76 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.314 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.6 t -162.46 56.8 0.22 Allowed 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.498 1.045 . . . . 0.0 112.319 177.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -114.07 146.31 40.4 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 121.3 -0.875 . . . . 0.0 111.653 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -148.62 120.69 8.27 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.311 1.844 . . . . 0.0 108.982 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.287 1.9 mp0 40.28 -105.33 0.05 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.106 1.762 . . . . 0.0 112.952 -175.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -97.17 -69.29 0.76 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 120.448 1.476 . . . . 0.0 111.12 163.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -134.81 132.03 6.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 124.107 0.861 . . . . 0.0 111.509 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 32.7 m170 44.13 -70.67 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 129.366 3.066 . . . . 0.0 118.455 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.38 -56.46 2.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.812 1.245 . . . . 0.0 110.5 -177.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -144.88 -70.44 0.28 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.075 1.75 . . . . 0.0 112.125 -173.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.93 -69.53 0.84 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.45 1.1 . . . . 0.0 110.61 -174.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.61 -74.65 0.14 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.169 0.987 . . . . 0.0 109.268 162.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -125.86 125.68 43.22 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.77 1.228 . . . . 0.0 112.605 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -163.33 55.76 0.18 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.428 2.291 . . . . 0.0 109.33 168.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -142.31 0.42 1.33 Allowed 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -174.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -138.11 176.29 8.83 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.689 1.595 . . . . 0.0 113.144 -161.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.14 3.42 64.99 Favored Glycine 0 CA--C 1.546 1.97 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 167.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -162.78 134.65 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 119.828 1.814 . . . . 0.0 111.359 171.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.2 p -150.65 161.83 41.84 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.387 1.075 . . . . 0.0 112.905 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -101.31 134.65 44.05 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.931 2.092 . . . . 0.0 108.713 156.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.658 0 C-N-CA 125.026 1.298 . . . . 0.0 113.809 -177.285 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.485 1.293 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? 56.29 -167.22 0.11 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.411 1.485 . . . . 0.0 111.62 -160.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.68 165.36 3.94 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.83 1.252 . . . . 0.0 112.718 171.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mm -48.38 118.86 7.16 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.152 0.981 . . . . 0.0 111.922 -173.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo . . . . . 0 C--N 1.355 0.886 0 C-N-CA 121.535 1.49 . . . . 0.0 110.142 174.182 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.777 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.79 -0.35 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 130.967 3.707 . . . . 0.0 116.552 -173.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.1 tptm -128.13 6.12 5.91 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.498 1.919 . . . . 0.0 113.801 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.63 -40.4 0.2 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -172.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.84 158.59 51.42 Favored Glycine 0 N--CA 1.473 1.163 0 O-C-N 121.342 -0.849 . . . . 0.0 114.343 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -74.1 -9.78 22.27 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 124.189 3.259 . . . . 0.0 112.748 171.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.2 p -74.76 160.29 30.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.314 1.446 . . . . 0.0 111.752 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 52.0 mt 70.93 143.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.344 1.857 . . . . 0.0 114.136 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 89.11 156.29 31.46 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.665 1.602 . . . . 0.0 115.579 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -68.02 80.56 0.22 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 123.319 1.533 . . . . 0.0 111.488 171.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.8 tptt -86.02 4.94 35.71 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.163 1.385 . . . . 0.0 111.718 160.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 C-N-CA 123.434 0.694 . . . . 0.0 110.344 -155.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 39.4 mt . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.282 0.2 OUTLIER 57.64 177.17 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 126.04 1.736 . . . . 0.0 113.723 -169.374 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 68.0 117.76 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.953 2.101 . . . . 0.0 116.637 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.362 7.8 pt-20 38.56 -94.43 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 128.559 2.744 . . . . 0.0 115.667 -176.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.3 mt -152.93 -53.2 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.892 1.677 . . . . 0.0 109.376 167.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -161.72 -56.72 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.87 2.068 . . . . 0.0 108.346 -174.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -156.92 49.39 0.46 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 127.297 2.239 . . . . 0.0 110.93 172.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.4 t70 55.1 36.2 26.44 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 169.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -67.5 -47.88 68.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 119.296 -2.128 . . . . 0.0 114.375 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -99.58 -3.3 33.62 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -166.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.3 mt 53.95 -95.61 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.597 1.559 . . . . 0.0 112.814 -172.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -146.51 149.58 33.91 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.691 1.996 . . . . 0.0 111.676 -172.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.09 -9.87 0.02 OUTLIER Glycine 0 N--CA 1.478 1.461 0 N-CA-C 116.288 1.275 . . . . 0.0 116.288 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -133.15 5.36 3.82 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.472 2.309 . . . . 0.0 114.609 -163.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -79.09 0.43 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.056 1.342 . . . . 0.0 111.605 172.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 t -136.37 -55.34 0.75 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.869 -1.144 . . . . 0.0 113.639 -175.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . 0.291 6.3 t 60.35 -96.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 127.336 2.254 . . . . 0.0 113.663 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.403 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER -166.83 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.845 1.258 . . . . 0.0 111.211 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.403 ' H ' ' HB3' ' A' ' 87' ' ' PHE . . . . . . . . 0 CA--C 1.536 1.381 0 C-N-CA 125.618 1.58 . . . . 0.0 115.701 176.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.857 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 ptm -54.99 -29.22 56.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -165.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.01 -9.02 15.72 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.172 1.389 . . . . 0.0 112.349 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -105.5 -41.84 6.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 125.245 1.418 . . . . 0.0 111.728 -166.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.3 t -121.9 118.66 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.326 1.45 . . . . 0.0 109.55 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.8 t 61.13 -36.86 0.1 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 129.266 3.026 . . . . 0.0 117.726 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.73 125.04 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 1 C-N-CA 131.755 4.022 . . . . 0.0 116.664 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.9 mmt-85 -146.02 -125.74 0.07 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 127.921 2.488 . . . . 0.0 108.285 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -165.32 -174.73 3.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.621 2.768 . . . . 0.0 108.184 -174.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 55.72 -119.04 1.32 Allowed 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.23 -1.367 . . . . 0.0 111.949 -176.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 56.5 -166.63 4.32 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.47 1.986 . . . . 0.0 115.669 176.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -157.17 -39.52 0.07 Allowed 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 173.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.67 -84.57 0.47 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.745 1.618 . . . . 0.0 113.574 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -112.87 -112.19 0.34 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.882 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.61 -60.07 3.81 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.882 1.674 . . . . 0.0 112.379 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -170.33 -55.55 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 128.604 2.762 . . . . 0.0 109.442 172.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -159.23 106.19 1.75 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.425 1.89 . . . . 0.0 109.803 -152.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.78 -13.03 0.11 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -168.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.7 p -104.65 38.1 1.98 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -170.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -152.34 178.92 9.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.73 1.212 . . . . 0.0 112.134 -172.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.79 6.37 67.56 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 116.681 1.433 . . . . 0.0 116.681 167.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.252 20.0 m -106.52 -59.0 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.566 1.683 . . . . 0.0 114.544 -170.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.74 139.83 18.35 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.646 1.566 . . . . 0.0 111.626 -178.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -106.35 154.9 20.12 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.698 1.199 . . . . 0.0 113.683 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.461 0 C-N-CA 124.743 1.163 . . . . 0.0 112.854 -169.1 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.163 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -156.22 178.2 10.56 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 128.253 2.621 . . . . 0.0 109.649 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.15 82.98 0.13 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 40.6 mm -115.94 72.58 4.43 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 126.535 1.934 . . . . 0.0 108.108 174.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo . . . . . 0 C--O 1.244 0.796 0 C-N-CA 122.77 2.313 . . . . 0.0 113.207 -169.727 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.697 0 CA-C-O 121.133 0.492 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -84.47 -11.89 55.32 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.359 1.464 . . . . 0.0 113.812 -178.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -122.46 162.76 21.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.587 2.355 . . . . 0.0 110.79 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 70.67 -37.64 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 169.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -86.74 -55.11 2.49 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.356 1.455 . . . . 0.0 114.563 172.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -79.23 -166.39 0.41 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.753 2.969 . . . . 0.0 112.1 176.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -63.26 152.33 38.01 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.073 -1.017 . . . . 0.0 111.369 158.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . 0.311 0.1 OUTLIER 73.73 152.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 129.532 3.133 . . . . 0.0 115.518 -171.356 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.82 5.02 73.33 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 118.619 2.207 . . . . 0.0 118.619 163.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -81.57 -104.71 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.883 2.341 . . . . 0.0 111.623 168.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -81.02 -5.5 57.68 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 -157.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 6.9 mt . . . . . 0 N--CA 1.487 1.396 0 C-N-CA 129.094 2.958 . . . . 0.0 114.57 -170.069 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.6 mt . . . . . 0 N--CA 1.47 0.561 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 tt -158.93 167.35 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.437 1.495 . . . . 0.0 110.689 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 75.78 117.87 0.06 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 128.847 2.859 . . . . 0.0 113.853 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.293 4.1 pt-20 40.53 -146.47 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.61 2.764 . . . . 0.0 116.149 174.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 39.5 mm -120.37 -70.49 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -129.99 -34.97 1.65 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.565 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt 179.68 83.07 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 126.752 2.021 . . . . 0.0 109.09 170.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -149.47 145.27 26.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -160.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -65.92 -9.84 33.26 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 165.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 65.68 5.75 3.5 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tt 65.81 115.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.538 2.335 . . . . 0.0 113.643 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.2 t80 67.5 130.77 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.439 1.896 . . . . 0.0 113.575 -175.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 131.9 -125.26 4.25 Favored Glycine 0 N--CA 1.473 1.142 0 O-C-N 121.083 -1.011 . . . . 0.0 110.805 -165.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -59.83 62.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 128.788 2.835 . . . . 0.0 112.185 169.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -167.09 -39.95 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.845 2.058 . . . . 0.0 110.585 -162.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.8 t -164.3 -46.62 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 173.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 t 45.1 -105.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 126.463 1.905 . . . . 0.0 113.952 -170.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -166.29 154.5 10.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.244 2.218 . . . . 0.0 109.35 -173.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.318 0 N-CA-C 115.006 0.763 . . . . 0.0 115.006 175.825 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.511 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ptp -58.1 86.02 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 127.238 2.215 . . . . 0.0 115.224 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 62.17 37.01 14.68 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 112.14 -167.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.1 mt -129.64 -76.56 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 125.375 1.47 . . . . 0.0 109.395 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.32 -32.39 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.03 0.932 . . . . 0.0 112.746 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.6 t -167.95 111.41 0.63 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.869 1.268 . . . . 0.0 109.581 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . 0.313 1.7 ppt_? -81.38 133.08 35.37 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 119.839 1.199 . . . . 0.0 113.574 176.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ttt-85 -149.72 -161.82 1.43 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 128.051 2.541 . . . . 0.0 107.73 171.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 66.88 156.93 0.11 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 167.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.97 -158.17 0.33 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.351 1.06 . . . . 0.0 110.994 -165.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.28 19.73 59.99 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 119.954 1.252 . . . . 0.0 115.113 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 26.8 m170 61.27 -43.8 0.13 Allowed 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 128.817 2.847 . . . . 0.0 115.35 -171.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 -67.66 0.88 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.977 1.711 . . . . 0.0 113.236 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -140.0 -90.89 0.17 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.523 1.129 . . . . 0.0 113.074 -175.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -87.46 -57.19 3.04 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.421 1.009 . . . . 0.0 110.511 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -171.6 -67.18 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 128.438 2.695 . . . . 0.0 106.586 161.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -105.73 165.93 10.82 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.717 2.007 . . . . 0.0 111.86 -175.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.28 9.12 5.39 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 118.808 2.892 . . . . 0.0 118.808 166.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.5 m -111.72 44.8 1.31 Allowed 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 119.771 1.169 . . . . 0.0 113.587 175.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.82 162.52 34.76 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.721 -1.237 . . . . 0.0 113.942 170.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.38 8.76 70.64 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 126.089 1.804 . . . . 0.0 114.563 -176.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -155.81 152.87 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 126.256 1.823 . . . . 0.0 110.128 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.1 151.78 28.71 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.518 2.327 . . . . 0.0 109.172 165.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.39 166.29 13.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.883 0.873 . . . . 0.0 110.434 162.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.637 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 177.38 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.95 167.64 9.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.109 1.364 . . . . 0.0 111.889 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 166.35 2.43 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.8 1.24 . . . . 0.0 113.306 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.9 mt -110.43 79.81 1.8 Allowed Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 124.455 1.102 . . . . 0.0 110.044 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 CA--C 1.539 0.731 0 C-N-CA 123.083 2.522 . . . . 0.0 110.526 164.53 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 115.428 1.64 . . . . 0.0 115.428 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.01 33.2 0.08 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 115.69 1.737 . . . . 0.0 115.69 -166.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -158.34 138.85 12.68 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.256 1.822 . . . . 0.0 108.432 170.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 67.32 -35.83 0.27 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -80.36 123.78 6.21 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-N 120.305 1.411 . . . . 0.0 112.307 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -81.12 -41.07 0.15 Allowed 'Trans proline' 0 C--N 1.362 1.242 0 C-N-CA 122.481 2.121 . . . . 0.0 111.787 177.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.2 p -69.61 172.95 6.6 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.701 1.6 . . . . 0.0 110.527 167.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 68.6 mt 67.41 -67.64 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.539 1.535 . . . . 0.0 110.22 -165.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 164.14 100.4 0.15 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 123.63 0.633 . . . . 0.0 114.065 170.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.77 -49.44 25.41 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.92 0.488 . . . . 0.0 111.405 173.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -146.0 95.44 2.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.01 0.924 . . . . 0.0 112.167 170.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.1 pp . . . . . 0 N--CA 1.476 0.843 0 C-N-CA 126.159 1.784 . . . . 0.0 110.344 -179.217 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.407 HG12 ' H ' ' A' ' 72' ' ' ALA 0.318 5.4 tt 49.12 -153.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 127.542 2.337 . . . . 0.0 113.044 176.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.407 ' H ' HG12 ' A' ' 71' ' ' ILE . . . 41.12 103.88 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 128.948 2.899 . . . . 0.0 117.013 173.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -68.9 175.4 3.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.545 -1.347 . . . . 0.0 113.043 168.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 10.5 mm -50.39 -53.41 12.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.653 1.181 . . . . 0.0 112.715 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -150.36 -60.66 0.19 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.178 1.791 . . . . 0.0 111.515 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -161.44 48.67 0.21 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 125.646 1.578 . . . . 0.0 112.591 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . 0.32 0.0 OUTLIER 63.79 -42.39 0.24 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.143 2.177 . . . . 0.0 116.075 -174.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -66.94 28.32 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 55.73 -25.69 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 130.879 3.671 . . . . 0.0 118.836 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.1 tt -142.65 -53.12 0.4 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.785 1.634 . . . . 0.0 111.271 -174.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -163.22 -40.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 167.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -168.83 -40.78 0.03 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.08 0.848 . . . . 0.0 113.87 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.35 166.02 30.26 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.468 2.307 . . . . 0.0 109.356 171.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.12 -35.21 7.69 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.7 t -146.99 -73.46 0.21 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.6 t 66.79 152.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 127.166 2.186 . . . . 0.0 113.889 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.259 0.2 OUTLIER 63.0 -142.41 0.37 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.534 1.534 . . . . 0.0 113.057 177.541 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.214 0 O-C-N 120.21 -1.556 . . . . 0.0 114.842 177.58 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.919 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 51.3 mtm -83.63 3.61 32.05 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.923 -1.111 . . . . 0.0 113.551 165.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -148.35 8.48 0.81 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 116.017 1.858 . . . . 0.0 116.017 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.3 mm -59.96 -42.26 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.733 -1.229 . . . . 0.0 113.671 -172.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.74 -71.36 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.869 0.867 . . . . 0.0 110.692 169.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -154.51 85.17 1.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.552 1.069 . . . . 0.0 111.979 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.2 mmt-85 -136.99 146.11 44.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.276 1.83 . . . . 0.0 110.222 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.64 -96.87 0.06 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 127.019 2.127 . . . . 0.0 106.405 149.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -132.51 -62.71 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.096 1.359 . . . . 0.0 111.55 161.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -154.79 173.35 16.58 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.086 2.154 . . . . 0.0 111.228 -177.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.1 -171.13 7.95 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.303 -0.873 . . . . 0.0 112.959 -169.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -143.65 -28.81 0.52 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.67 -99.19 0.45 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.872 1.269 . . . . 0.0 111.229 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -111.29 -104.56 0.38 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.434 1.494 . . . . 0.0 111.599 -167.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -73.12 -54.3 8.84 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.625 1.102 . . . . 0.0 110.956 177.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.08 -56.44 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.337 1.855 . . . . 0.0 110.497 157.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -131.69 108.84 9.76 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.417 1.487 . . . . 0.0 111.575 -164.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -165.37 47.36 0.09 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.088 0.955 . . . . 0.0 112.868 -175.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.1 p -155.13 6.65 0.25 Allowed 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 116.825 2.158 . . . . 0.0 116.825 -171.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.29 -170.8 3.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.255 1.422 . . . . 0.0 110.799 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.86 7.21 88.44 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 115.966 1.146 . . . . 0.0 115.966 170.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.26 19.7 m 48.76 83.09 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 127.952 2.501 . . . . 0.0 113.54 -177.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -57.4 147.29 26.58 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.051 1.34 . . . . 0.0 114.12 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 129.87 55.15 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.367 1.467 . . . . 0.0 109.823 -175.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.494 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -171.812 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 122.174 0.988 . . . . 0.0 111.773 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -170.06 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.254 1.822 . . . . 0.0 112.86 -176.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.26 156.77 0.15 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.563 1.145 . . . . 0.0 113.114 174.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.8 mp -102.04 86.54 0.88 Allowed Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 167.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 CA--C 1.539 0.754 0 C-N-CA 123.275 2.65 . . . . 0.0 110.984 177.073 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 CA-C-O 119.273 -0.394 . . . . 0.0 110.413 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 61.78 -50.42 0.14 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.299 2.64 . . . . 0.0 117.044 173.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.3 138.88 58.68 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.759 2.423 . . . . 0.0 111.521 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 62.05 -49.59 0.16 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 128.275 2.63 . . . . 0.0 116.165 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -124.11 96.43 0.53 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.012 1.768 . . . . 0.0 110.404 170.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.17 55.54 4.07 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 124.331 3.354 . . . . 0.0 111.341 169.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.12 158.13 19.23 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.181 2.592 . . . . 0.0 110.892 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.8 mt 58.54 52.46 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 122.697 1.236 . . . . 0.0 110.567 -160.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.43 136.26 12.61 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 125.26 1.41 . . . . 0.0 111.813 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -97.42 -19.74 18.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.459 1.504 . . . . 0.0 113.236 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.23 53.02 0.96 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.15 1.38 . . . . 0.0 112.361 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.8 mm . . . . . 0 CA--C 1.541 0.634 0 C-N-CA 127.234 2.213 . . . . 0.0 108.768 -174.999 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 CA--C 1.549 0.934 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.278 1.5 tp 57.06 -163.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 125.949 1.7 . . . . 0.0 114.839 166.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 65.7 -125.1 0.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -124.23 159.38 30.29 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.197 2.199 . . . . 0.0 112.397 -168.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.2 mt -73.72 -40.89 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.247 -0.908 . . . . 0.0 112.092 -170.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -49.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.851 1.26 . . . . 0.0 110.136 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -164.81 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.517 1.527 . . . . 0.0 113.007 170.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.52 38.23 0.54 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.901 0.88 . . . . 0.0 113.084 -175.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -74.19 -67.64 0.6 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -172.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.88 -0.55 31.19 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.163 1.347 . . . . 0.0 114.071 -176.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.1 mt 56.35 -177.23 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.017 1.327 . . . . 0.0 111.9 -160.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 45.35 -149.79 0.08 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.609 1.964 . . . . 0.0 114.845 177.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 73.04 34.51 58.51 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.2 -0.937 . . . . 0.0 113.385 -175.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -138.51 141.02 39.38 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.976 1.71 . . . . 0.0 110.804 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -78.2 -36.23 47.55 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -169.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -156.37 -53.12 0.08 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 -170.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 56.83 1.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 127.491 2.316 . . . . 0.0 115.714 -177.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.07 150.96 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.141 2.177 . . . . 0.0 114.477 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.387 0 N-CA-C 115.577 0.991 . . . . 0.0 115.577 179.127 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.384 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 52.0 mtm -69.62 114.81 8.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.469 1.031 . . . . 0.0 109.265 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 49.85 32.01 5.07 Favored 'General case' 0 CA--C 1.557 1.243 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -167.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.2 mt -127.4 -89.05 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.543 1.137 . . . . 0.0 109.253 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 88.3 t -103.09 -79.23 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.726 1.148 . . . . 0.0 111.297 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.5 t -81.74 80.55 8.03 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.61 1.095 . . . . 0.0 112.153 -171.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 45.4 mtt-85 -74.76 99.95 3.88 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 127.107 2.163 . . . . 0.0 111.378 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.63 130.04 12.12 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.539 1.535 . . . . 0.0 112.079 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 58.24 152.66 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.855 2.462 . . . . 0.0 116.116 -173.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 58.13 -161.12 0.24 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.838 0.855 . . . . 0.0 112.852 -167.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.57 -166.06 35.51 Favored Glycine 0 C--N 1.344 0.974 0 O-C-N 121.36 -0.838 . . . . 0.0 114.321 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -153.03 -72.99 0.14 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.84 -0.8 . . . . 0.0 112.77 173.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -69.12 0.86 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.578 1.151 . . . . 0.0 112.681 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -141.39 119.12 11.73 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.628 1.571 . . . . 0.0 109.521 -177.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 64.76 -61.75 0.2 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.734 2.414 . . . . 0.0 115.209 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -166.9 -57.04 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.49 2.716 . . . . 0.0 108.434 162.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.72 171.82 13.56 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.925 1.69 . . . . 0.0 112.43 -173.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.33 44.23 0.47 Allowed 'General case' 0 C--O 1.244 0.803 0 C-N-CA 123.948 0.899 . . . . 0.0 111.499 166.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.1 p -142.09 7.77 1.82 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 117.302 2.334 . . . . 0.0 117.302 -163.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -144.2 -143.7 0.15 Allowed 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 120.335 1.425 . . . . 0.0 112.093 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.18 -147.49 31.76 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 119.807 1.185 . . . . 0.0 115.019 172.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 23.7 t 66.84 -27.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 128.588 2.755 . . . . 0.0 115.941 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.39 -176.08 0.15 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.295 1.438 . . . . 0.0 113.932 171.253 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 t -137.95 128.64 26.76 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.271 1.828 . . . . 0.0 107.139 157.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.171 0 CA-C-O 118.828 -0.985 . . . . 0.0 114.989 -172.016 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.538 0.494 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.84 151.47 23.06 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . 58.77 30.47 20.06 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.6 mt -137.85 99.22 9.33 Favored Pre-proline 0 CA--C 1.554 1.123 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo . . . . . 0 CA--C 1.539 0.773 0 C-N-CA 124.298 3.332 . . . . 0.0 112.424 -179.109 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.849 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -56.51 -22.5 33.23 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.393 1.877 . . . . 0.0 114.49 -173.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -116.3 -51.37 2.62 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.48 1.912 . . . . 0.0 111.351 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -160.15 -31.54 0.06 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 176.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.2 -144.93 7.56 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 124.071 0.843 . . . . 0.0 112.298 -169.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.3 -177.55 3.53 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.765 2.977 . . . . 0.0 111.436 171.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 m -154.48 -22.42 0.13 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.968 -1.082 . . . . 0.0 113.651 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -148.56 16.96 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 124.333 1.053 . . . . 0.0 111.61 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.7 -153.86 46.31 Favored Glycine 0 CA--C 1.543 1.784 0 O-C-N 119.862 -1.774 . . . . 0.0 112.267 -154.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -91.3 70.77 6.12 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.08 0.952 . . . . 0.0 112.933 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -154.8 71.06 0.79 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.589 1.555 . . . . 0.0 110.049 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 53.0 mt . . . . . 0 N--CA 1.483 1.211 0 C-N-CA 126.508 1.923 . . . . 0.0 109.144 -173.918 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.288 1.1 mp 68.79 148.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.245 2.218 . . . . 0.0 114.047 -176.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 59.67 114.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.049 2.54 . . . . 0.0 115.277 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.316 17.1 pt-20 39.08 -133.72 0.15 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.21 1.804 . . . . 0.0 115.751 -177.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.1 pt -147.45 -68.51 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 125.94 1.696 . . . . 0.0 112.256 -168.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -159.37 -66.13 0.08 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.668 1.187 . . . . 0.0 110.684 -175.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.01 -74.11 0.33 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.633 1.173 . . . . 0.0 111.601 169.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -139.97 160.1 40.68 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.022 1.729 . . . . 0.0 108.423 164.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -161.03 -36.74 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 54.34 15.13 0.9 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.31 -70.25 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 126.484 1.914 . . . . 0.0 111.549 -161.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -147.8 143.19 27.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.27 1.828 . . . . 0.0 109.208 165.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 152.78 -10.36 0.58 Allowed Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.132 0.872 . . . . 0.0 114.761 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -123.15 92.81 3.78 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.965 1.706 . . . . 0.0 110.489 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -165.98 -74.27 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.098 1.759 . . . . 0.0 110.09 165.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.53 -45.73 0.09 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 t -139.38 -122.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 124.824 1.25 . . . . 0.0 109.367 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.1 146.13 13.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.922 1.289 . . . . 0.0 109.365 175.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.465 0 C-N-CA 123.756 0.693 . . . . 0.0 114.356 179.72 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.47 0.535 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -132.68 -44.99 0.88 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.068 1.347 . . . . 0.0 113.67 -172.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -137.92 -73.07 0.41 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.821 1.248 . . . . 0.0 112.758 -172.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.08 118.73 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 129.047 2.939 . . . . 0.0 117.182 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -73.8 -52.47 12.98 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 120.198 -1.564 . . . . 0.0 113.163 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 75.1 m -96.99 12.95 30.63 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 -166.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.295 0.0 OUTLIER 41.8 34.36 0.41 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 128.041 2.536 . . . . 0.0 116.694 175.306 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -163.25 -31.2 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.461 2.305 . . . . 0.0 112.319 176.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.91 -39.69 40.8 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 126.141 1.776 . . . . 0.0 114.815 -171.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -72.65 15.91 0.17 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.658 1.583 . . . . 0.0 114.584 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -144.09 -11.49 0.65 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.431 -1.418 . . . . 0.0 113.586 178.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -54.05 -39.44 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 125.14 1.376 . . . . 0.0 112.62 -173.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.8 p -146.23 -61.76 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.314 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.6 t -162.46 56.8 0.22 Allowed 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.498 1.045 . . . . 0.0 112.319 177.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -114.07 146.31 40.4 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 121.3 -0.875 . . . . 0.0 111.653 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -148.62 120.69 8.27 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.311 1.844 . . . . 0.0 108.982 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.287 1.9 mp0 40.28 -105.33 0.05 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.106 1.762 . . . . 0.0 112.952 -175.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -97.17 -69.29 0.76 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 120.448 1.476 . . . . 0.0 111.12 163.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -134.81 132.03 6.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 124.107 0.861 . . . . 0.0 111.509 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 32.7 m170 44.13 -70.67 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 129.366 3.066 . . . . 0.0 118.455 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.38 -56.46 2.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.812 1.245 . . . . 0.0 110.5 -177.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -144.88 -70.44 0.28 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.075 1.75 . . . . 0.0 112.125 -173.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.93 -69.53 0.84 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.45 1.1 . . . . 0.0 110.61 -174.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.61 -74.65 0.14 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.169 0.987 . . . . 0.0 109.268 162.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -125.86 125.68 43.22 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.77 1.228 . . . . 0.0 112.605 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -163.33 55.76 0.18 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.428 2.291 . . . . 0.0 109.33 168.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -142.31 0.42 1.33 Allowed 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -174.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -138.11 176.29 8.83 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.689 1.595 . . . . 0.0 113.144 -161.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.14 3.42 64.99 Favored Glycine 0 CA--C 1.546 1.97 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 167.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -162.78 134.65 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 119.828 1.814 . . . . 0.0 111.359 171.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.2 p -150.65 161.83 41.84 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.387 1.075 . . . . 0.0 112.905 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -101.31 134.65 44.05 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.931 2.092 . . . . 0.0 108.713 156.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 170.34 169.01 32.96 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.026 1.298 . . . . 0.0 113.809 -177.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -139.31 85.94 14.96 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 126.039 1.736 . . . . 0.0 111.752 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.83 -30.66 26.58 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.787 2.325 . . . . 0.0 114.333 -174.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -106.99 -18.35 13.93 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -175.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 76.8 m -113.18 74.03 1.86 Allowed Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 125.467 1.507 . . . . 0.0 112.293 -178.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.62 37.66 0.37 Allowed 'Trans proline' 0 CA--C 1.556 1.576 0 C-N-CA 124.646 3.564 . . . . 0.0 114.701 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -160.03 20.86 0.16 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.038 1.735 . . . . 0.0 113.057 -172.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m -66.69 -32.47 73.79 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 119.917 -1.74 . . . . 0.0 114.184 -171.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? 56.29 -167.22 0.11 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.411 1.485 . . . . 0.0 111.62 -160.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.68 165.36 3.94 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.83 1.252 . . . . 0.0 112.718 171.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mm -48.38 118.86 7.16 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.152 0.981 . . . . 0.0 111.922 -173.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -68.92 140.43 45.88 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.535 1.49 . . . . 0.0 110.142 174.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -122.59 75.02 1.23 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.315 1.846 . . . . 0.0 106.662 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -71.09 -18.32 62.54 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 -158.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -100.39 6.22 44.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.542 1.937 . . . . 0.0 111.95 172.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -152.39 50.21 0.77 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.696 1.998 . . . . 0.0 110.605 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.57 5.29 11.25 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.639 1.576 . . . . 0.0 113.676 177.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.79 -0.35 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 130.967 3.707 . . . . 0.0 116.552 -173.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.1 tptm -128.13 6.12 5.91 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.498 1.919 . . . . 0.0 113.801 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.63 -40.4 0.2 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -172.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.84 158.59 51.42 Favored Glycine 0 N--CA 1.473 1.163 0 O-C-N 121.342 -0.849 . . . . 0.0 114.343 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -74.1 -9.78 22.27 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 124.189 3.259 . . . . 0.0 112.748 171.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.2 p -74.76 160.29 30.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.314 1.446 . . . . 0.0 111.752 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 52.0 mt 70.93 143.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.344 1.857 . . . . 0.0 114.136 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 89.11 156.29 31.46 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.665 1.602 . . . . 0.0 115.579 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -68.02 80.56 0.22 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 123.319 1.533 . . . . 0.0 111.488 171.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.8 tptt -86.02 4.94 35.71 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.163 1.385 . . . . 0.0 111.718 160.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -82.64 -74.72 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.434 0.694 . . . . 0.0 110.344 -155.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -121.88 -20.38 6.4 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -171.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.0 -0.48 14.75 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.621 1.168 . . . . 0.0 111.784 -177.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -78.38 -176.26 46.65 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.173 1.368 . . . . 0.0 114.353 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -122.3 53.46 1.23 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.871 1.269 . . . . 0.0 111.263 -167.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.92 -18.0 0.22 Allowed 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 116.955 2.206 . . . . 0.0 116.955 -175.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 54.54 85.08 0.06 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.015 1.726 . . . . 0.0 115.544 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 39.4 mt -133.29 -48.13 0.84 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.987 1.715 . . . . 0.0 112.523 170.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.282 0.2 OUTLIER 57.64 177.17 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 126.04 1.736 . . . . 0.0 113.723 -169.374 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 68.0 117.76 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.953 2.101 . . . . 0.0 116.637 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.362 7.8 pt-20 38.56 -94.43 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 128.559 2.744 . . . . 0.0 115.667 -176.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.3 mt -152.93 -53.2 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.892 1.677 . . . . 0.0 109.376 167.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -161.72 -56.72 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.87 2.068 . . . . 0.0 108.346 -174.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -156.92 49.39 0.46 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 127.297 2.239 . . . . 0.0 110.93 172.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.4 t70 55.1 36.2 26.44 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 169.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -67.5 -47.88 68.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 119.296 -2.128 . . . . 0.0 114.375 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -99.58 -3.3 33.62 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -166.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.3 mt 53.95 -95.61 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.597 1.559 . . . . 0.0 112.814 -172.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -146.51 149.58 33.91 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.691 1.996 . . . . 0.0 111.676 -172.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.09 -9.87 0.02 OUTLIER Glycine 0 N--CA 1.478 1.461 0 N-CA-C 116.288 1.275 . . . . 0.0 116.288 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -133.15 5.36 3.82 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.472 2.309 . . . . 0.0 114.609 -163.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -79.09 0.43 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.056 1.342 . . . . 0.0 111.605 172.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 t -136.37 -55.34 0.75 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.869 -1.144 . . . . 0.0 113.639 -175.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . 0.291 6.3 t 60.35 -96.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 127.336 2.254 . . . . 0.0 113.663 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.403 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER -166.83 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.845 1.258 . . . . 0.0 111.211 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.403 ' H ' ' HB3' ' A' ' 87' ' ' PHE . . . -72.22 -168.61 11.2 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 125.618 1.58 . . . . 0.0 115.701 176.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 167.12 -153.1 22.44 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.706 1.146 . . . . 0.0 112.327 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -74.38 62.84 2.23 Favored Glycine 0 N--CA 1.472 1.074 0 C-N-CA 125.22 1.39 . . . . 0.0 114.927 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -145.57 110.84 5.3 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.295 1.038 . . . . 0.0 110.65 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -137.05 -155.49 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 126.324 1.85 . . . . 0.0 111.043 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.9 tp . . . . . 0 N--CA 1.485 1.282 0 C-N-CA 127.379 2.272 . . . . 0.0 113.806 -167.65 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.7 p . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 119.802 -0.142 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 53.2 t30 60.32 -67.52 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 129.234 3.013 . . . . 0.0 114.453 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -131.56 -45.79 0.98 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.396 1.479 . . . . 0.0 111.544 177.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 64.33 127.18 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 128.601 2.76 . . . . 0.0 116.52 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -134.31 -89.97 0.36 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.782 2.033 . . . . 0.0 108.849 174.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.5 m -77.4 63.69 2.62 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.183 1.793 . . . . 0.0 111.414 -175.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 23.94 75.87 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 128.599 2.759 . . . . 0.0 113.723 169.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 58.4 1.64 0.18 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.33 -38.17 35.81 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 121.392 1.905 . . . . 0.0 111.826 168.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 ptm -54.99 -29.22 56.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -165.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.01 -9.02 15.72 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.172 1.389 . . . . 0.0 112.349 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -105.5 -41.84 6.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 125.245 1.418 . . . . 0.0 111.728 -166.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.3 t -121.9 118.66 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.326 1.45 . . . . 0.0 109.55 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.8 t 61.13 -36.86 0.1 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 129.266 3.026 . . . . 0.0 117.726 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.73 125.04 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 1 C-N-CA 131.755 4.022 . . . . 0.0 116.664 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.9 mmt-85 -146.02 -125.74 0.07 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 127.921 2.488 . . . . 0.0 108.285 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -165.32 -174.73 3.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.621 2.768 . . . . 0.0 108.184 -174.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 55.72 -119.04 1.32 Allowed 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.23 -1.367 . . . . 0.0 111.949 -176.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 56.5 -166.63 4.32 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.47 1.986 . . . . 0.0 115.669 176.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -157.17 -39.52 0.07 Allowed 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 173.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.67 -84.57 0.47 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.745 1.618 . . . . 0.0 113.574 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -112.87 -112.19 0.34 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.882 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.61 -60.07 3.81 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.882 1.674 . . . . 0.0 112.379 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -170.33 -55.55 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 128.604 2.762 . . . . 0.0 109.442 172.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -159.23 106.19 1.75 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.425 1.89 . . . . 0.0 109.803 -152.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.78 -13.03 0.11 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -168.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.7 p -104.65 38.1 1.98 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -170.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -152.34 178.92 9.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.73 1.212 . . . . 0.0 112.134 -172.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.79 6.37 67.56 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 116.681 1.433 . . . . 0.0 116.681 167.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.252 20.0 m -106.52 -59.0 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.566 1.683 . . . . 0.0 114.544 -170.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.74 139.83 18.35 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.646 1.566 . . . . 0.0 111.626 -178.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -106.35 154.9 20.12 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.698 1.199 . . . . 0.0 113.683 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 90.72 -173.31 38.24 Favored Glycine 0 N--CA 1.478 1.461 0 C-N-CA 124.743 1.163 . . . . 0.0 112.854 -169.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -76.92 128.85 80.42 Favored Pre-proline 0 CA--C 1.549 0.915 0 O-C-N 121.61 -0.935 . . . . 0.0 112.527 -163.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -96.17 -51.14 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 123.673 2.915 . . . . 0.0 113.845 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -108.69 33.23 4.32 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 126.038 1.735 . . . . 0.0 110.304 -177.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -147.75 153.93 43.42 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 125.82 1.648 . . . . 0.0 111.969 -175.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -77.54 3.26 6.98 Favored 'Trans proline' 0 C--O 1.238 0.477 0 C-N-CA 123.474 2.782 . . . . 0.0 115.663 -163.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.54 -32.02 53.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.676 1.191 . . . . 0.0 112.639 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 53.85 -147.57 0.49 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 126.331 1.853 . . . . 0.0 113.813 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -156.22 178.2 10.56 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 128.253 2.621 . . . . 0.0 109.649 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.15 82.98 0.13 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 40.6 mm -115.94 72.58 4.43 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 126.535 1.934 . . . . 0.0 108.108 174.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -62.48 148.35 93.44 Favored 'Trans proline' 0 C--O 1.244 0.796 0 C-N-CA 122.77 2.313 . . . . 0.0 113.207 -169.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -74.26 65.6 1.2 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.062 1.745 . . . . 0.0 112.05 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -51.14 -35.86 37.9 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.636 1.574 . . . . 0.0 113.28 -176.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -95.97 -4.75 42.71 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.134 1.373 . . . . 0.0 113.439 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -147.51 25.05 1.09 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -168.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.52 54.58 1.78 Allowed 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.217 -1.552 . . . . 0.0 110.41 172.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -84.47 -11.89 55.32 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.359 1.464 . . . . 0.0 113.812 -178.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -122.46 162.76 21.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.587 2.355 . . . . 0.0 110.79 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 70.67 -37.64 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 169.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -86.74 -55.11 2.49 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.356 1.455 . . . . 0.0 114.563 172.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -79.23 -166.39 0.41 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.753 2.969 . . . . 0.0 112.1 176.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -63.26 152.33 38.01 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.073 -1.017 . . . . 0.0 111.369 158.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . 0.311 0.1 OUTLIER 73.73 152.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 129.532 3.133 . . . . 0.0 115.518 -171.356 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.82 5.02 73.33 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 118.619 2.207 . . . . 0.0 118.619 163.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -81.57 -104.71 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.883 2.341 . . . . 0.0 111.623 168.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -81.02 -5.5 57.68 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 -157.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 6.9 mt -32.23 -51.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 129.094 2.958 . . . . 0.0 114.57 -170.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -139.98 -25.51 0.8 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.21 1.404 . . . . 0.0 112.349 162.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -90.9 26.21 2.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.666 1.587 . . . . 0.0 112.207 -177.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -76.43 -162.12 13.14 Favored Glycine 0 CA--C 1.536 1.35 0 CA-C-O 121.992 0.773 . . . . 0.0 112.009 164.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -137.82 -35.54 0.64 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.923 1.289 . . . . 0.0 112.025 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.0 t -93.83 -25.08 17.51 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 174.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.84 166.81 11.29 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -162.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.6 mt -92.6 -92.04 0.16 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -167.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 tt -158.93 167.35 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.437 1.495 . . . . 0.0 110.689 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 75.78 117.87 0.06 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 128.847 2.859 . . . . 0.0 113.853 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.293 4.1 pt-20 40.53 -146.47 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.61 2.764 . . . . 0.0 116.149 174.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 39.5 mm -120.37 -70.49 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -129.99 -34.97 1.65 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.565 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt 179.68 83.07 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 126.752 2.021 . . . . 0.0 109.09 170.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -149.47 145.27 26.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -160.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -65.92 -9.84 33.26 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 165.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 65.68 5.75 3.5 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tt 65.81 115.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.538 2.335 . . . . 0.0 113.643 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.2 t80 67.5 130.77 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.439 1.896 . . . . 0.0 113.575 -175.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 131.9 -125.26 4.25 Favored Glycine 0 N--CA 1.473 1.142 0 O-C-N 121.083 -1.011 . . . . 0.0 110.805 -165.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -59.83 62.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 128.788 2.835 . . . . 0.0 112.185 169.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -167.09 -39.95 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.845 2.058 . . . . 0.0 110.585 -162.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.8 t -164.3 -46.62 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 173.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 t 45.1 -105.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 126.463 1.905 . . . . 0.0 113.952 -170.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -166.29 154.5 10.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.244 2.218 . . . . 0.0 109.35 -173.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -166.03 -171.0 31.68 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 115.006 0.763 . . . . 0.0 115.006 175.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -161.57 -160.06 10.58 Favored Glycine 0 CA--C 1.54 1.627 0 C-N-CA 125.901 1.715 . . . . 0.0 112.901 -176.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 119.06 71.04 0.35 Allowed Glycine 0 CA--C 1.538 1.481 0 C-N-CA 123.945 0.783 . . . . 0.0 113.175 174.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -138.4 135.84 35.68 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.389 1.476 . . . . 0.0 111.255 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 59.4 t -103.23 33.52 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 125.813 1.645 . . . . 0.0 112.252 -176.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.8 mp . . . . . 0 C--O 1.255 1.383 0 C-N-CA 127.12 2.168 . . . . 0.0 108.84 170.13 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.1 t . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.6 m120 58.86 -69.52 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 127.504 2.321 . . . . 0.0 115.726 173.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -134.4 -65.8 0.63 Allowed 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 127.852 2.461 . . . . 0.0 108.621 171.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 54.98 141.12 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 128.406 2.682 . . . . 0.0 116.596 -176.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -76.48 -95.14 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.646 1.178 . . . . 0.0 111.396 170.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.5 m -78.07 52.5 1.09 Allowed 'General case' 0 CA--C 1.542 0.659 0 O-C-N 120.699 -1.251 . . . . 0.0 114.249 -170.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 17.41 77.05 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 128.668 2.787 . . . . 0.0 116.903 166.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 54.19 24.59 5.04 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -111.19 -27.48 8.68 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.869 2.068 . . . . 0.0 113.735 175.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ptp -58.1 86.02 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 127.238 2.215 . . . . 0.0 115.224 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 62.17 37.01 14.68 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 112.14 -167.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.1 mt -129.64 -76.56 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 125.375 1.47 . . . . 0.0 109.395 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.32 -32.39 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.03 0.932 . . . . 0.0 112.746 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.6 t -167.95 111.41 0.63 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.869 1.268 . . . . 0.0 109.581 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . 0.313 1.7 ppt_? -81.38 133.08 35.37 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 119.839 1.199 . . . . 0.0 113.574 176.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ttt-85 -149.72 -161.82 1.43 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 128.051 2.541 . . . . 0.0 107.73 171.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 66.88 156.93 0.11 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 167.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.97 -158.17 0.33 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.351 1.06 . . . . 0.0 110.994 -165.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.28 19.73 59.99 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 119.954 1.252 . . . . 0.0 115.113 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 26.8 m170 61.27 -43.8 0.13 Allowed 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 128.817 2.847 . . . . 0.0 115.35 -171.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 -67.66 0.88 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.977 1.711 . . . . 0.0 113.236 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -140.0 -90.89 0.17 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.523 1.129 . . . . 0.0 113.074 -175.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -87.46 -57.19 3.04 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.421 1.009 . . . . 0.0 110.511 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -171.6 -67.18 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 128.438 2.695 . . . . 0.0 106.586 161.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -105.73 165.93 10.82 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.717 2.007 . . . . 0.0 111.86 -175.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.28 9.12 5.39 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 118.808 2.892 . . . . 0.0 118.808 166.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.5 m -111.72 44.8 1.31 Allowed 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 119.771 1.169 . . . . 0.0 113.587 175.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.82 162.52 34.76 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.721 -1.237 . . . . 0.0 113.942 170.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.38 8.76 70.64 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 126.089 1.804 . . . . 0.0 114.563 -176.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -155.81 152.87 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 126.256 1.823 . . . . 0.0 110.128 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.1 151.78 28.71 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.518 2.327 . . . . 0.0 109.172 165.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.39 166.29 13.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.883 0.873 . . . . 0.0 110.434 162.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 153.73 105.1 0.25 Allowed Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 177.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -115.62 75.24 4.96 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -167.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -63.11 -30.1 75.08 Favored 'Trans proline' 0 C--N 1.36 1.16 0 C-N-CA 123.883 3.056 . . . . 0.0 113.628 -177.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -103.39 -3.79 25.0 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.163 1.385 . . . . 0.0 113.018 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.1 m -135.0 59.18 32.44 Favored Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 124.619 1.168 . . . . 0.0 112.138 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -65.61 -37.28 29.68 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.536 2.158 . . . . 0.0 113.937 -174.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.73 24.47 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 167.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 p -81.45 159.39 24.27 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -167.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.95 167.64 9.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.109 1.364 . . . . 0.0 111.889 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 166.35 2.43 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.8 1.24 . . . . 0.0 113.306 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.9 mt -110.43 79.81 1.8 Allowed Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 124.455 1.102 . . . . 0.0 110.044 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -75.01 165.44 31.31 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.083 2.522 . . . . 0.0 110.526 164.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -87.02 102.35 14.32 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -84.46 2.21 41.95 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.564 1.145 . . . . 0.0 113.699 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -145.29 3.9 1.04 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.567 1.547 . . . . 0.0 112.828 -164.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -168.4 172.7 8.15 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 129.555 3.142 . . . . 0.0 107.203 -174.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -144.67 40.61 1.3 Allowed 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 121.526 1.966 . . . . 0.0 115.428 -170.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.01 33.2 0.08 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 115.69 1.737 . . . . 0.0 115.69 -166.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -158.34 138.85 12.68 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.256 1.822 . . . . 0.0 108.432 170.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 67.32 -35.83 0.27 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -80.36 123.78 6.21 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-N 120.305 1.411 . . . . 0.0 112.307 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -81.12 -41.07 0.15 Allowed 'Trans proline' 0 C--N 1.362 1.242 0 C-N-CA 122.481 2.121 . . . . 0.0 111.787 177.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.2 p -69.61 172.95 6.6 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.701 1.6 . . . . 0.0 110.527 167.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 68.6 mt 67.41 -67.64 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.539 1.535 . . . . 0.0 110.22 -165.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 164.14 100.4 0.15 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 123.63 0.633 . . . . 0.0 114.065 170.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.77 -49.44 25.41 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.92 0.488 . . . . 0.0 111.405 173.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -146.0 95.44 2.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.01 0.924 . . . . 0.0 112.167 170.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.1 pp -136.73 -124.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 126.159 1.784 . . . . 0.0 110.344 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 26.7 mtp180 -58.55 -38.53 78.0 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 126.159 1.784 . . . . 0.0 113.603 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.22 45.41 1.07 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.506 1.122 . . . . 0.0 110.112 175.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -97.43 -108.65 2.64 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 125.157 1.36 . . . . 0.0 111.167 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -160.49 -55.75 0.05 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.164 1.385 . . . . 0.0 109.488 174.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -155.38 39.7 0.4 Allowed 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 122.625 1.202 . . . . 0.0 112.303 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -93.0 -168.38 1.92 Allowed 'General case' 0 CA--C 1.555 1.148 0 O-C-N 120.599 -1.313 . . . . 0.0 111.862 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.61 27.01 0.54 Allowed 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -169.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.407 HG12 ' H ' ' A' ' 72' ' ' ALA 0.318 5.4 tt 49.12 -153.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 127.542 2.337 . . . . 0.0 113.044 176.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.407 ' H ' HG12 ' A' ' 71' ' ' ILE . . . 41.12 103.88 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 128.948 2.899 . . . . 0.0 117.013 173.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -68.9 175.4 3.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.545 -1.347 . . . . 0.0 113.043 168.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 10.5 mm -50.39 -53.41 12.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.653 1.181 . . . . 0.0 112.715 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -150.36 -60.66 0.19 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.178 1.791 . . . . 0.0 111.515 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -161.44 48.67 0.21 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 125.646 1.578 . . . . 0.0 112.591 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . 0.32 0.0 OUTLIER 63.79 -42.39 0.24 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.143 2.177 . . . . 0.0 116.075 -174.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -66.94 28.32 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 55.73 -25.69 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 130.879 3.671 . . . . 0.0 118.836 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.1 tt -142.65 -53.12 0.4 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.785 1.634 . . . . 0.0 111.271 -174.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -163.22 -40.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 167.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -168.83 -40.78 0.03 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.08 0.848 . . . . 0.0 113.87 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.35 166.02 30.26 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.468 2.307 . . . . 0.0 109.356 171.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.12 -35.21 7.69 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.7 t -146.99 -73.46 0.21 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.6 t 66.79 152.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 127.166 2.186 . . . . 0.0 113.889 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.259 0.2 OUTLIER 63.0 -142.41 0.37 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.534 1.534 . . . . 0.0 113.057 177.541 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.93 -158.92 19.61 Favored Glycine 0 CA--C 1.533 1.214 0 O-C-N 120.21 -1.556 . . . . 0.0 114.842 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 153.89 -169.09 32.44 Favored Glycine 0 CA--C 1.543 1.833 0 C-N-CA 124.523 1.058 . . . . 0.0 113.883 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 167.23 103.72 0.17 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 123.833 0.73 . . . . 0.0 112.714 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -141.29 120.81 13.25 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.19 1.396 . . . . 0.0 110.59 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 1.7 t -123.61 23.97 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 125.76 1.624 . . . . 0.0 111.714 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mp . . . . . 0 C--O 1.244 0.787 0 C-N-CA 126.652 1.981 . . . . 0.0 108.788 173.117 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 39.4 t30 58.08 -60.91 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 128.328 2.651 . . . . 0.0 116.536 -173.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -141.61 149.11 40.28 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.764 1.165 . . . . 0.0 111.887 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 44.9 -144.43 0.16 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.063 1.345 . . . . 0.0 111.765 -166.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -162.82 -43.92 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.962 -1.086 . . . . 0.0 112.508 160.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 58.9 m -91.79 11.84 23.39 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.824 1.25 . . . . 0.0 112.655 -176.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.313 0.0 OUTLIER 49.49 -11.48 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 131.434 3.894 . . . . 0.0 120.867 173.327 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.35 -18.25 9.26 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.338 1.855 . . . . 0.0 112.823 166.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.98 0.07 0.99 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 -176.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 51.3 mtm -83.63 3.61 32.05 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.923 -1.111 . . . . 0.0 113.551 165.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -148.35 8.48 0.81 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 116.017 1.858 . . . . 0.0 116.017 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.3 mm -59.96 -42.26 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.733 -1.229 . . . . 0.0 113.671 -172.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.74 -71.36 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.869 0.867 . . . . 0.0 110.692 169.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -154.51 85.17 1.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.552 1.069 . . . . 0.0 111.979 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.2 mmt-85 -136.99 146.11 44.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.276 1.83 . . . . 0.0 110.222 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.64 -96.87 0.06 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 127.019 2.127 . . . . 0.0 106.405 149.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -132.51 -62.71 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.096 1.359 . . . . 0.0 111.55 161.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -154.79 173.35 16.58 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.086 2.154 . . . . 0.0 111.228 -177.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.1 -171.13 7.95 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.303 -0.873 . . . . 0.0 112.959 -169.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -143.65 -28.81 0.52 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.67 -99.19 0.45 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.872 1.269 . . . . 0.0 111.229 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -111.29 -104.56 0.38 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.434 1.494 . . . . 0.0 111.599 -167.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -73.12 -54.3 8.84 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.625 1.102 . . . . 0.0 110.956 177.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.08 -56.44 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.337 1.855 . . . . 0.0 110.497 157.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -131.69 108.84 9.76 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.417 1.487 . . . . 0.0 111.575 -164.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -165.37 47.36 0.09 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.088 0.955 . . . . 0.0 112.868 -175.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.1 p -155.13 6.65 0.25 Allowed 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 116.825 2.158 . . . . 0.0 116.825 -171.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.29 -170.8 3.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.255 1.422 . . . . 0.0 110.799 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.86 7.21 88.44 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 115.966 1.146 . . . . 0.0 115.966 170.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.26 19.7 m 48.76 83.09 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 127.952 2.501 . . . . 0.0 113.54 -177.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -57.4 147.29 26.58 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.051 1.34 . . . . 0.0 114.12 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 129.87 55.15 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.367 1.467 . . . . 0.0 109.823 -175.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 178.46 71.29 0.06 OUTLIER Glycine 0 CA--C 1.522 0.494 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -171.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -130.64 51.9 8.44 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 126.051 1.74 . . . . 0.0 111.744 -167.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -62.52 -34.07 76.58 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.859 3.04 . . . . 0.0 114.086 -170.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -98.88 1.88 46.14 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.433 1.893 . . . . 0.0 112.537 173.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 73.2 m -125.71 38.72 0.42 Allowed Pre-proline 0 CA--C 1.554 1.124 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 -170.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.78 -21.25 64.85 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.94 2.427 . . . . 0.0 114.83 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -154.32 39.32 0.45 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.566 1.075 . . . . 0.0 113.205 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.2 m -63.43 145.01 56.47 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.086 -1.009 . . . . 0.0 111.773 -170.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -170.06 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.254 1.822 . . . . 0.0 112.86 -176.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.26 156.77 0.15 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.563 1.145 . . . . 0.0 113.114 174.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.8 mp -102.04 86.54 0.88 Allowed Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 167.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -74.9 -171.94 1.11 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.275 2.65 . . . . 0.0 110.984 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -67.66 64.71 0.08 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.771 1.229 . . . . 0.0 111.168 167.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -48.54 -42.42 33.26 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 120.108 1.322 . . . . 0.0 113.601 -177.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -74.45 -20.35 60.05 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.668 1.187 . . . . 0.0 113.973 177.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -140.81 46.27 1.77 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.465 1.906 . . . . 0.0 110.673 -168.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.97 -120.92 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.873 1.269 . . . . 0.0 110.413 -174.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 61.78 -50.42 0.14 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.299 2.64 . . . . 0.0 117.044 173.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.3 138.88 58.68 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.759 2.423 . . . . 0.0 111.521 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 62.05 -49.59 0.16 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 128.275 2.63 . . . . 0.0 116.165 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -124.11 96.43 0.53 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.012 1.768 . . . . 0.0 110.404 170.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.17 55.54 4.07 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 124.331 3.354 . . . . 0.0 111.341 169.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.12 158.13 19.23 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.181 2.592 . . . . 0.0 110.892 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.8 mt 58.54 52.46 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 122.697 1.236 . . . . 0.0 110.567 -160.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.43 136.26 12.61 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 125.26 1.41 . . . . 0.0 111.813 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -97.42 -19.74 18.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.459 1.504 . . . . 0.0 113.236 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.23 53.02 0.96 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.15 1.38 . . . . 0.0 112.361 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.8 mm -114.86 -100.05 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 127.234 2.213 . . . . 0.0 108.768 -174.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -95.13 -14.66 23.98 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 177.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.83 12.66 22.84 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.449 1.5 . . . . 0.0 111.558 165.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -72.56 -119.63 0.06 OUTLIER Glycine 0 CA--C 1.531 1.093 0 C-N-CA 125.497 1.523 . . . . 0.0 112.726 174.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -155.44 -58.3 0.1 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.175 0.99 . . . . 0.0 110.021 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.7 t -147.29 31.81 0.91 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 122.252 1.025 . . . . 0.0 112.637 170.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -77.1 -178.63 5.12 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.84 1.256 . . . . 0.0 111.604 175.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.4 mt -74.63 16.13 0.3 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -167.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.278 1.5 tp 57.06 -163.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 125.949 1.7 . . . . 0.0 114.839 166.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 65.7 -125.1 0.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -124.23 159.38 30.29 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.197 2.199 . . . . 0.0 112.397 -168.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.2 mt -73.72 -40.89 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.247 -0.908 . . . . 0.0 112.092 -170.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -49.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.851 1.26 . . . . 0.0 110.136 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -164.81 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.517 1.527 . . . . 0.0 113.007 170.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.52 38.23 0.54 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.901 0.88 . . . . 0.0 113.084 -175.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -74.19 -67.64 0.6 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -172.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.88 -0.55 31.19 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.163 1.347 . . . . 0.0 114.071 -176.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.1 mt 56.35 -177.23 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.017 1.327 . . . . 0.0 111.9 -160.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 45.35 -149.79 0.08 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.609 1.964 . . . . 0.0 114.845 177.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 73.04 34.51 58.51 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.2 -0.937 . . . . 0.0 113.385 -175.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -138.51 141.02 39.38 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.976 1.71 . . . . 0.0 110.804 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -78.2 -36.23 47.55 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -169.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -156.37 -53.12 0.08 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 -170.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 56.83 1.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 127.491 2.316 . . . . 0.0 115.714 -177.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.07 150.96 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.141 2.177 . . . . 0.0 114.477 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -164.52 -176.51 36.35 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 115.577 0.991 . . . . 0.0 115.577 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 173.77 174.26 40.57 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 127.076 2.274 . . . . 0.0 111.443 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 162.37 86.6 0.06 OUTLIER Glycine 0 CA--C 1.534 1.279 0 CA-C-N 117.708 0.754 . . . . 0.0 113.465 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -149.24 146.06 27.41 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.44 1.096 . . . . 0.0 112.61 -175.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -141.9 -153.35 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 126.395 1.878 . . . . 0.0 109.764 173.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 96.7 mt . . . . . 0 N--CA 1.484 1.252 0 C-N-CA 127.485 2.314 . . . . 0.0 111.31 -171.275 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.4 m-20 51.86 -111.44 0.57 Allowed 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 125.137 1.375 . . . . 0.0 110.932 -173.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -74.93 -54.29 7.48 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.977 1.262 . . . . 0.0 113.444 174.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.07 100.35 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.739 2.016 . . . . 0.0 115.021 -159.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -94.95 -30.25 14.24 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.258 1.423 . . . . 0.0 112.526 174.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 71.0 m -102.67 -0.4 31.84 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.539 1.936 . . . . 0.0 113.432 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.26 0.0 OUTLIER 46.73 43.54 13.02 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.049 2.14 . . . . 0.0 115.134 171.232 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 60.65 71.83 0.55 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.775 2.43 . . . . 0.0 113.97 -176.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -134.15 -44.01 0.79 Allowed 'General case' 0 C--N 1.348 0.528 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -171.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 52.0 mtm -69.62 114.81 8.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.469 1.031 . . . . 0.0 109.265 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 49.85 32.01 5.07 Favored 'General case' 0 CA--C 1.557 1.243 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -167.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.2 mt -127.4 -89.05 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.543 1.137 . . . . 0.0 109.253 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 88.3 t -103.09 -79.23 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.726 1.148 . . . . 0.0 111.297 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.5 t -81.74 80.55 8.03 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.61 1.095 . . . . 0.0 112.153 -171.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 45.4 mtt-85 -74.76 99.95 3.88 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 127.107 2.163 . . . . 0.0 111.378 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.63 130.04 12.12 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.539 1.535 . . . . 0.0 112.079 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 58.24 152.66 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.855 2.462 . . . . 0.0 116.116 -173.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 58.13 -161.12 0.24 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.838 0.855 . . . . 0.0 112.852 -167.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.57 -166.06 35.51 Favored Glycine 0 C--N 1.344 0.974 0 O-C-N 121.36 -0.838 . . . . 0.0 114.321 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -153.03 -72.99 0.14 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.84 -0.8 . . . . 0.0 112.77 173.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -69.12 0.86 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.578 1.151 . . . . 0.0 112.681 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -141.39 119.12 11.73 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.628 1.571 . . . . 0.0 109.521 -177.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 64.76 -61.75 0.2 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.734 2.414 . . . . 0.0 115.209 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -166.9 -57.04 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.49 2.716 . . . . 0.0 108.434 162.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.72 171.82 13.56 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.925 1.69 . . . . 0.0 112.43 -173.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.33 44.23 0.47 Allowed 'General case' 0 C--O 1.244 0.803 0 C-N-CA 123.948 0.899 . . . . 0.0 111.499 166.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.1 p -142.09 7.77 1.82 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 117.302 2.334 . . . . 0.0 117.302 -163.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -144.2 -143.7 0.15 Allowed 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 120.335 1.425 . . . . 0.0 112.093 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.18 -147.49 31.76 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 119.807 1.185 . . . . 0.0 115.019 172.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 23.7 t 66.84 -27.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 128.588 2.755 . . . . 0.0 115.941 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.39 -176.08 0.15 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.295 1.438 . . . . 0.0 113.932 171.253 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 t -137.95 128.64 26.76 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.271 1.828 . . . . 0.0 107.139 157.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 176.44 55.08 0.06 OUTLIER Glycine 0 CA--C 1.533 1.171 0 CA-C-O 118.828 -0.985 . . . . 0.0 114.989 -172.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.17 111.73 26.83 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 124.764 1.226 . . . . 0.0 111.706 173.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -86.35 -31.11 0.32 Allowed 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.723 2.949 . . . . 0.0 114.577 174.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -119.39 -25.77 5.98 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.66 1.184 . . . . 0.0 113.132 -173.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 95.2 m -73.37 160.46 82.44 Favored Pre-proline 0 CA--C 1.558 1.288 0 C-N-CA 123.842 0.857 . . . . 0.0 111.519 170.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -80.1 61.5 8.22 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.483 2.788 . . . . 0.0 113.522 -173.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -136.3 43.36 2.49 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.203 -0.935 . . . . 0.0 111.952 176.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 m -50.33 125.27 12.22 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.542 1.537 . . . . 0.0 112.942 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.84 151.47 23.06 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . 58.77 30.47 20.06 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.6 mt -137.85 99.22 9.33 Favored Pre-proline 0 CA--C 1.554 1.123 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.81 60.33 6.69 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 124.298 3.332 . . . . 0.0 112.424 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.73 49.72 0.32 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.004 1.721 . . . . 0.0 113.675 -178.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.23 -22.36 66.92 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 120.134 -1.603 . . . . 0.0 112.13 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -89.54 -2.36 58.32 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 176.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -153.43 157.83 40.51 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 120.774 1.624 . . . . 0.0 113.894 -173.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.97 36.92 25.62 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -56.51 -22.5 33.23 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.393 1.877 . . . . 0.0 114.49 -173.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -116.3 -51.37 2.62 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.48 1.912 . . . . 0.0 111.351 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -160.15 -31.54 0.06 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 176.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.2 -144.93 7.56 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 124.071 0.843 . . . . 0.0 112.298 -169.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.3 -177.55 3.53 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.765 2.977 . . . . 0.0 111.436 171.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 m -154.48 -22.42 0.13 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.968 -1.082 . . . . 0.0 113.651 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -148.56 16.96 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 124.333 1.053 . . . . 0.0 111.61 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.7 -153.86 46.31 Favored Glycine 0 CA--C 1.543 1.784 0 O-C-N 119.862 -1.774 . . . . 0.0 112.267 -154.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -91.3 70.77 6.12 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.08 0.952 . . . . 0.0 112.933 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -154.8 71.06 0.79 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.589 1.555 . . . . 0.0 110.049 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 53.0 mt -150.44 -57.92 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 126.508 1.923 . . . . 0.0 109.144 -173.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 16.6 mtm180 -136.51 13.16 3.23 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.725 2.01 . . . . 0.0 111.379 160.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -125.1 -3.26 7.58 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.37 1.868 . . . . 0.0 113.948 -158.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -75.3 -95.86 0.14 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-N 119.295 0.952 . . . . 0.0 111.103 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -150.06 -39.53 0.14 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.475 1.11 . . . . 0.0 112.417 164.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 52.1 m -140.51 79.29 1.7 Allowed 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 122.55 1.166 . . . . 0.0 109.046 174.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -84.23 161.95 20.34 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.193 1.397 . . . . 0.0 111.02 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.82 -7.96 55.73 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 175.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.288 1.1 mp 68.79 148.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.245 2.218 . . . . 0.0 114.047 -176.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 59.67 114.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.049 2.54 . . . . 0.0 115.277 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.316 17.1 pt-20 39.08 -133.72 0.15 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.21 1.804 . . . . 0.0 115.751 -177.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.1 pt -147.45 -68.51 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 125.94 1.696 . . . . 0.0 112.256 -168.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -159.37 -66.13 0.08 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.668 1.187 . . . . 0.0 110.684 -175.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.01 -74.11 0.33 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.633 1.173 . . . . 0.0 111.601 169.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -139.97 160.1 40.68 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.022 1.729 . . . . 0.0 108.423 164.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -161.03 -36.74 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 54.34 15.13 0.9 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.31 -70.25 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 126.484 1.914 . . . . 0.0 111.549 -161.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -147.8 143.19 27.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.27 1.828 . . . . 0.0 109.208 165.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 152.78 -10.36 0.58 Allowed Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.132 0.872 . . . . 0.0 114.761 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -123.15 92.81 3.78 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.965 1.706 . . . . 0.0 110.489 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -165.98 -74.27 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.098 1.759 . . . . 0.0 110.09 165.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.53 -45.73 0.09 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 t -139.38 -122.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 124.824 1.25 . . . . 0.0 109.367 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.1 146.13 13.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.922 1.289 . . . . 0.0 109.365 175.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -165.18 -178.07 38.11 Favored Glycine 0 N--CA 1.478 1.465 0 C-N-CA 123.756 0.693 . . . . 0.0 114.356 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 179.87 58.76 0.08 OUTLIER Glycine 0 CA--C 1.533 1.191 0 N-CA-C 116.24 1.256 . . . . 0.0 116.24 -174.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -157.34 -166.94 17.67 Favored Glycine 0 N--CA 1.478 1.452 0 C-N-CA 124.494 1.045 . . . . 0.0 113.721 173.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.41 141.75 20.61 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 118.171 0.986 . . . . 0.0 112.781 162.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 93.7 t -94.14 158.8 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.9 1.68 . . . . 0.0 109.014 158.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.3 tp . . . . . 0 N--CA 1.482 1.125 0 C-N-CA 127.501 2.32 . . . . 0.0 114.975 -174.087 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.085 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -72.65 15.91 0.17 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.658 1.583 . . . . 0.0 114.584 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -144.09 -11.49 0.65 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.431 -1.418 . . . . 0.0 113.586 178.189 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -54.05 -39.44 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 125.14 1.376 . . . . 0.0 112.62 -173.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.8 p -146.23 -61.76 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.314 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.6 t -162.46 56.8 0.22 Allowed 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.498 1.045 . . . . 0.0 112.319 177.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -114.07 146.31 40.4 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 121.3 -0.875 . . . . 0.0 111.653 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -148.62 120.69 8.27 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.311 1.844 . . . . 0.0 108.982 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.287 1.9 mp0 40.28 -105.33 0.05 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.106 1.762 . . . . 0.0 112.952 -175.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -97.17 -69.29 0.76 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 120.448 1.476 . . . . 0.0 111.12 163.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -134.81 132.03 6.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 124.107 0.861 . . . . 0.0 111.509 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 32.7 m170 44.13 -70.67 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 129.366 3.066 . . . . 0.0 118.455 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.38 -56.46 2.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.812 1.245 . . . . 0.0 110.5 -177.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -144.88 -70.44 0.28 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.075 1.75 . . . . 0.0 112.125 -173.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.93 -69.53 0.84 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.45 1.1 . . . . 0.0 110.61 -174.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.61 -74.65 0.14 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.169 0.987 . . . . 0.0 109.268 162.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -125.86 125.68 43.22 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.77 1.228 . . . . 0.0 112.605 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -163.33 55.76 0.18 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.428 2.291 . . . . 0.0 109.33 168.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -142.31 0.42 1.33 Allowed 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -174.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -138.11 176.29 8.83 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.689 1.595 . . . . 0.0 113.144 -161.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.14 3.42 64.99 Favored Glycine 0 CA--C 1.546 1.97 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 167.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -162.78 134.65 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 119.828 1.814 . . . . 0.0 111.359 171.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.2 p -150.65 161.83 41.84 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.387 1.075 . . . . 0.0 112.905 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -101.31 134.65 44.05 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.931 2.092 . . . . 0.0 108.713 156.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.658 0 C-N-CA 125.026 1.298 . . . . 0.0 113.809 -177.285 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.485 1.293 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? 56.29 -167.22 0.11 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.411 1.485 . . . . 0.0 111.62 -160.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.68 165.36 3.94 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.83 1.252 . . . . 0.0 112.718 171.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mm -48.38 118.86 7.16 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.152 0.981 . . . . 0.0 111.922 -173.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo . . . . . 0 C--N 1.355 0.886 0 C-N-CA 121.535 1.49 . . . . 0.0 110.142 174.182 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.777 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.79 -0.35 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 130.967 3.707 . . . . 0.0 116.552 -173.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.1 tptm -128.13 6.12 5.91 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.498 1.919 . . . . 0.0 113.801 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.63 -40.4 0.2 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -172.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.84 158.59 51.42 Favored Glycine 0 N--CA 1.473 1.163 0 O-C-N 121.342 -0.849 . . . . 0.0 114.343 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -74.1 -9.78 22.27 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 124.189 3.259 . . . . 0.0 112.748 171.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.2 p -74.76 160.29 30.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.314 1.446 . . . . 0.0 111.752 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 52.0 mt 70.93 143.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.344 1.857 . . . . 0.0 114.136 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 89.11 156.29 31.46 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.665 1.602 . . . . 0.0 115.579 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -68.02 80.56 0.22 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 123.319 1.533 . . . . 0.0 111.488 171.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.8 tptt -86.02 4.94 35.71 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.163 1.385 . . . . 0.0 111.718 160.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 C-N-CA 123.434 0.694 . . . . 0.0 110.344 -155.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 39.4 mt . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.282 0.2 OUTLIER 57.64 177.17 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 126.04 1.736 . . . . 0.0 113.723 -169.374 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 68.0 117.76 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.953 2.101 . . . . 0.0 116.637 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.362 7.8 pt-20 38.56 -94.43 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 128.559 2.744 . . . . 0.0 115.667 -176.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.3 mt -152.93 -53.2 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.892 1.677 . . . . 0.0 109.376 167.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -161.72 -56.72 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.87 2.068 . . . . 0.0 108.346 -174.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -156.92 49.39 0.46 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 127.297 2.239 . . . . 0.0 110.93 172.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.4 t70 55.1 36.2 26.44 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 169.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -67.5 -47.88 68.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 119.296 -2.128 . . . . 0.0 114.375 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -99.58 -3.3 33.62 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -166.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.3 mt 53.95 -95.61 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.597 1.559 . . . . 0.0 112.814 -172.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -146.51 149.58 33.91 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.691 1.996 . . . . 0.0 111.676 -172.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.09 -9.87 0.02 OUTLIER Glycine 0 N--CA 1.478 1.461 0 N-CA-C 116.288 1.275 . . . . 0.0 116.288 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -133.15 5.36 3.82 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.472 2.309 . . . . 0.0 114.609 -163.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -79.09 0.43 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.056 1.342 . . . . 0.0 111.605 172.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 t -136.37 -55.34 0.75 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.869 -1.144 . . . . 0.0 113.639 -175.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . 0.291 6.3 t 60.35 -96.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 127.336 2.254 . . . . 0.0 113.663 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.409 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER -166.83 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.845 1.258 . . . . 0.0 111.211 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.409 ' H ' ' HB3' ' A' ' 87' ' ' PHE . . . . . . . . 0 CA--C 1.536 1.381 0 C-N-CA 125.618 1.58 . . . . 0.0 115.701 176.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.857 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 ptm -54.99 -29.22 56.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -165.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.01 -9.02 15.72 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.172 1.389 . . . . 0.0 112.349 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -105.5 -41.84 6.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 125.245 1.418 . . . . 0.0 111.728 -166.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.3 t -121.9 118.66 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.326 1.45 . . . . 0.0 109.55 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.8 t 61.13 -36.86 0.1 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 129.266 3.026 . . . . 0.0 117.726 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.73 125.04 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 1 C-N-CA 131.755 4.022 . . . . 0.0 116.664 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.9 mmt-85 -146.02 -125.74 0.07 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 127.921 2.488 . . . . 0.0 108.285 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -165.32 -174.73 3.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.621 2.768 . . . . 0.0 108.184 -174.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 55.72 -119.04 1.32 Allowed 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.23 -1.367 . . . . 0.0 111.949 -176.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 56.5 -166.63 4.32 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.47 1.986 . . . . 0.0 115.669 176.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -157.17 -39.52 0.07 Allowed 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 173.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.67 -84.57 0.47 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.745 1.618 . . . . 0.0 113.574 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -112.87 -112.19 0.34 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.882 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.61 -60.07 3.81 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.882 1.674 . . . . 0.0 112.379 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -170.33 -55.55 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 128.604 2.762 . . . . 0.0 109.442 172.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -159.23 106.19 1.75 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.425 1.89 . . . . 0.0 109.803 -152.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.78 -13.03 0.11 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -168.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.7 p -104.65 38.1 1.98 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -170.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -152.34 178.92 9.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.73 1.212 . . . . 0.0 112.134 -172.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.79 6.37 67.56 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 116.681 1.433 . . . . 0.0 116.681 167.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.252 20.0 m -106.52 -59.0 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.566 1.683 . . . . 0.0 114.544 -170.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.74 139.83 18.35 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.646 1.566 . . . . 0.0 111.626 -178.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -106.35 154.9 20.12 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.698 1.199 . . . . 0.0 113.683 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.461 0 C-N-CA 124.743 1.163 . . . . 0.0 112.854 -169.1 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.163 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -156.22 178.2 10.56 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 128.253 2.621 . . . . 0.0 109.649 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.15 82.98 0.13 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 40.6 mm -115.94 72.58 4.43 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 126.535 1.934 . . . . 0.0 108.108 174.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo . . . . . 0 C--O 1.244 0.796 0 C-N-CA 122.77 2.313 . . . . 0.0 113.207 -169.727 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.697 0 CA-C-O 121.133 0.492 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -84.47 -11.89 55.32 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.359 1.464 . . . . 0.0 113.812 -178.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -122.46 162.76 21.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.587 2.355 . . . . 0.0 110.79 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 70.67 -37.64 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 169.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -86.74 -55.11 2.49 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.356 1.455 . . . . 0.0 114.563 172.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -79.23 -166.39 0.41 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.753 2.969 . . . . 0.0 112.1 176.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -63.26 152.33 38.01 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.073 -1.017 . . . . 0.0 111.369 158.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . 0.311 0.1 OUTLIER 73.73 152.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 129.532 3.133 . . . . 0.0 115.518 -171.356 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.82 5.02 73.33 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 118.619 2.207 . . . . 0.0 118.619 163.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -81.57 -104.71 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.883 2.341 . . . . 0.0 111.623 168.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -81.02 -5.5 57.68 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 -157.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.425 HG13 ' H ' ' A' ' 63' ' ' ILE . 6.9 mt . . . . . 0 N--CA 1.487 1.396 0 C-N-CA 129.094 2.958 . . . . 0.0 114.57 -170.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.6 mt . . . . . 0 N--CA 1.47 0.561 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 tt -158.93 167.35 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.437 1.495 . . . . 0.0 110.689 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 75.78 117.87 0.06 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 128.847 2.859 . . . . 0.0 113.853 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.293 4.1 pt-20 40.53 -146.47 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.61 2.764 . . . . 0.0 116.149 174.027 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 39.5 mm -120.37 -70.49 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -129.99 -34.97 1.65 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.565 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt 179.68 83.07 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 126.752 2.021 . . . . 0.0 109.09 170.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -149.47 145.27 26.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -160.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -65.92 -9.84 33.26 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 165.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 65.68 5.75 3.5 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tt 65.81 115.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.538 2.335 . . . . 0.0 113.643 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.2 t80 67.5 130.77 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.439 1.896 . . . . 0.0 113.575 -175.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 131.9 -125.26 4.25 Favored Glycine 0 N--CA 1.473 1.142 0 O-C-N 121.083 -1.011 . . . . 0.0 110.805 -165.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -59.83 62.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 128.788 2.835 . . . . 0.0 112.185 169.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -167.09 -39.95 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.845 2.058 . . . . 0.0 110.585 -162.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.8 t -164.3 -46.62 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 173.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 t 45.1 -105.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 126.463 1.905 . . . . 0.0 113.952 -170.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -166.29 154.5 10.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.244 2.218 . . . . 0.0 109.35 -173.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.318 0 N-CA-C 115.006 0.763 . . . . 0.0 115.006 175.825 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.437 ' HA ' ' H ' ' A' ' 16' ' ' VAL . . . . . . . . 0 CA--C 1.538 0.511 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ptp -58.1 86.02 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 127.238 2.215 . . . . 0.0 115.224 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 62.17 37.01 14.68 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 112.14 -167.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.1 mt -129.64 -76.56 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 125.375 1.47 . . . . 0.0 109.395 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.437 ' H ' ' HA ' ' A' ' 12' ' ' ALA . 0.3 OUTLIER -100.32 -32.39 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.03 0.932 . . . . 0.0 112.746 -179.715 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.6 t -167.95 111.41 0.63 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.869 1.268 . . . . 0.0 109.581 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . 0.313 1.7 ppt_? -81.38 133.08 35.37 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 119.839 1.199 . . . . 0.0 113.574 176.115 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ttt-85 -149.72 -161.82 1.43 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 128.051 2.541 . . . . 0.0 107.73 171.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 66.88 156.93 0.11 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 167.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.97 -158.17 0.33 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.351 1.06 . . . . 0.0 110.994 -165.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.28 19.73 59.99 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 119.954 1.252 . . . . 0.0 115.113 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 26.8 m170 61.27 -43.8 0.13 Allowed 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 128.817 2.847 . . . . 0.0 115.35 -171.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 -67.66 0.88 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.977 1.711 . . . . 0.0 113.236 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -140.0 -90.89 0.17 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.523 1.129 . . . . 0.0 113.074 -175.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -87.46 -57.19 3.04 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.421 1.009 . . . . 0.0 110.511 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -171.6 -67.18 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 128.438 2.695 . . . . 0.0 106.586 161.045 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -105.73 165.93 10.82 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.717 2.007 . . . . 0.0 111.86 -175.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.28 9.12 5.39 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 118.808 2.892 . . . . 0.0 118.808 166.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.5 m -111.72 44.8 1.31 Allowed 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 119.771 1.169 . . . . 0.0 113.587 175.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.82 162.52 34.76 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.721 -1.237 . . . . 0.0 113.942 170.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.38 8.76 70.64 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 126.089 1.804 . . . . 0.0 114.563 -176.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -155.81 152.87 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 126.256 1.823 . . . . 0.0 110.128 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.1 151.78 28.71 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.518 2.327 . . . . 0.0 109.172 165.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.39 166.29 13.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.883 0.873 . . . . 0.0 110.434 162.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.637 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 177.38 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.95 167.64 9.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.109 1.364 . . . . 0.0 111.889 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 166.35 2.43 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.8 1.24 . . . . 0.0 113.306 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.9 mt -110.43 79.81 1.8 Allowed Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 124.455 1.102 . . . . 0.0 110.044 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 CA--C 1.539 0.731 0 C-N-CA 123.083 2.522 . . . . 0.0 110.526 164.53 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 115.428 1.64 . . . . 0.0 115.428 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.01 33.2 0.08 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 115.69 1.737 . . . . 0.0 115.69 -166.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -158.34 138.85 12.68 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.256 1.822 . . . . 0.0 108.432 170.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 67.32 -35.83 0.27 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -80.36 123.78 6.21 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-N 120.305 1.411 . . . . 0.0 112.307 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -81.12 -41.07 0.15 Allowed 'Trans proline' 0 C--N 1.362 1.242 0 C-N-CA 122.481 2.121 . . . . 0.0 111.787 177.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.2 p -69.61 172.95 6.6 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.701 1.6 . . . . 0.0 110.527 167.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 68.6 mt 67.41 -67.64 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.539 1.535 . . . . 0.0 110.22 -165.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 164.14 100.4 0.15 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 123.63 0.633 . . . . 0.0 114.065 170.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.77 -49.44 25.41 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.92 0.488 . . . . 0.0 111.405 173.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -146.0 95.44 2.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.01 0.924 . . . . 0.0 112.167 170.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.1 pp . . . . . 0 N--CA 1.476 0.843 0 C-N-CA 126.159 1.784 . . . . 0.0 110.344 -179.217 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.447 HG12 ' H ' ' A' ' 72' ' ' ALA 0.318 5.4 tt 49.12 -153.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 127.542 2.337 . . . . 0.0 113.044 176.186 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.447 ' H ' HG12 ' A' ' 71' ' ' ILE . . . 41.12 103.88 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 128.948 2.899 . . . . 0.0 117.013 173.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -68.9 175.4 3.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.545 -1.347 . . . . 0.0 113.043 168.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 10.5 mm -50.39 -53.41 12.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.653 1.181 . . . . 0.0 112.715 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -150.36 -60.66 0.19 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.178 1.791 . . . . 0.0 111.515 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -161.44 48.67 0.21 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 125.646 1.578 . . . . 0.0 112.591 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . 0.32 0.0 OUTLIER 63.79 -42.39 0.24 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.143 2.177 . . . . 0.0 116.075 -174.589 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -66.94 28.32 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 55.73 -25.69 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 130.879 3.671 . . . . 0.0 118.836 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.1 tt -142.65 -53.12 0.4 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.785 1.634 . . . . 0.0 111.271 -174.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -163.22 -40.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 167.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -168.83 -40.78 0.03 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.08 0.848 . . . . 0.0 113.87 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.35 166.02 30.26 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.468 2.307 . . . . 0.0 109.356 171.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.12 -35.21 7.69 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.7 t -146.99 -73.46 0.21 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.6 t 66.79 152.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 127.166 2.186 . . . . 0.0 113.889 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.259 0.2 OUTLIER 63.0 -142.41 0.37 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.534 1.534 . . . . 0.0 113.057 177.541 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.214 0 O-C-N 120.21 -1.556 . . . . 0.0 114.842 177.58 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.919 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 51.3 mtm -83.63 3.61 32.05 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.923 -1.111 . . . . 0.0 113.551 165.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -148.35 8.48 0.81 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 116.017 1.858 . . . . 0.0 116.017 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.3 mm -59.96 -42.26 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.733 -1.229 . . . . 0.0 113.671 -172.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.74 -71.36 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.869 0.867 . . . . 0.0 110.692 169.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -154.51 85.17 1.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.552 1.069 . . . . 0.0 111.979 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.2 mmt-85 -136.99 146.11 44.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.276 1.83 . . . . 0.0 110.222 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.64 -96.87 0.06 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 127.019 2.127 . . . . 0.0 106.405 149.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -132.51 -62.71 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.096 1.359 . . . . 0.0 111.55 161.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -154.79 173.35 16.58 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.086 2.154 . . . . 0.0 111.228 -177.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.1 -171.13 7.95 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.303 -0.873 . . . . 0.0 112.959 -169.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -143.65 -28.81 0.52 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.67 -99.19 0.45 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.872 1.269 . . . . 0.0 111.229 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -111.29 -104.56 0.38 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.434 1.494 . . . . 0.0 111.599 -167.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -73.12 -54.3 8.84 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.625 1.102 . . . . 0.0 110.956 177.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.08 -56.44 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.337 1.855 . . . . 0.0 110.497 157.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -131.69 108.84 9.76 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.417 1.487 . . . . 0.0 111.575 -164.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -165.37 47.36 0.09 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.088 0.955 . . . . 0.0 112.868 -175.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.1 p -155.13 6.65 0.25 Allowed 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 116.825 2.158 . . . . 0.0 116.825 -171.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.29 -170.8 3.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.255 1.422 . . . . 0.0 110.799 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.86 7.21 88.44 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 115.966 1.146 . . . . 0.0 115.966 170.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.26 19.7 m 48.76 83.09 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 127.952 2.501 . . . . 0.0 113.54 -177.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -57.4 147.29 26.58 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.051 1.34 . . . . 0.0 114.12 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 129.87 55.15 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.367 1.467 . . . . 0.0 109.823 -175.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.494 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -171.812 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 122.174 0.988 . . . . 0.0 111.773 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -170.06 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.254 1.822 . . . . 0.0 112.86 -176.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.26 156.77 0.15 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.563 1.145 . . . . 0.0 113.114 174.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.8 mp -102.04 86.54 0.88 Allowed Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 167.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 CA--C 1.539 0.754 0 C-N-CA 123.275 2.65 . . . . 0.0 110.984 177.073 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 CA-C-O 119.273 -0.394 . . . . 0.0 110.413 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 61.78 -50.42 0.14 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.299 2.64 . . . . 0.0 117.044 173.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.3 138.88 58.68 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.759 2.423 . . . . 0.0 111.521 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 62.05 -49.59 0.16 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 128.275 2.63 . . . . 0.0 116.165 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -124.11 96.43 0.53 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.012 1.768 . . . . 0.0 110.404 170.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.17 55.54 4.07 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 124.331 3.354 . . . . 0.0 111.341 169.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.12 158.13 19.23 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.181 2.592 . . . . 0.0 110.892 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.8 mt 58.54 52.46 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 122.697 1.236 . . . . 0.0 110.567 -160.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.43 136.26 12.61 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 125.26 1.41 . . . . 0.0 111.813 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -97.42 -19.74 18.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.459 1.504 . . . . 0.0 113.236 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.23 53.02 0.96 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.15 1.38 . . . . 0.0 112.361 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.8 mm . . . . . 0 CA--C 1.541 0.634 0 C-N-CA 127.234 2.213 . . . . 0.0 108.768 -174.999 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 CA--C 1.549 0.934 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.278 1.5 tp 57.06 -163.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 125.949 1.7 . . . . 0.0 114.839 166.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 65.7 -125.1 0.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -124.23 159.38 30.29 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.197 2.199 . . . . 0.0 112.397 -168.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.2 mt -73.72 -40.89 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.247 -0.908 . . . . 0.0 112.092 -170.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -49.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.851 1.26 . . . . 0.0 110.136 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -164.81 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.517 1.527 . . . . 0.0 113.007 170.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.52 38.23 0.54 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.901 0.88 . . . . 0.0 113.084 -175.125 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -74.19 -67.64 0.6 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -172.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.88 -0.55 31.19 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.163 1.347 . . . . 0.0 114.071 -176.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.1 mt 56.35 -177.23 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.017 1.327 . . . . 0.0 111.9 -160.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 45.35 -149.79 0.08 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.609 1.964 . . . . 0.0 114.845 177.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 73.04 34.51 58.51 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.2 -0.937 . . . . 0.0 113.385 -175.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -138.51 141.02 39.38 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.976 1.71 . . . . 0.0 110.804 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -78.2 -36.23 47.55 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -169.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -156.37 -53.12 0.08 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 -170.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 56.83 1.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 127.491 2.316 . . . . 0.0 115.714 -177.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.07 150.96 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.141 2.177 . . . . 0.0 114.477 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.387 0 N-CA-C 115.577 0.991 . . . . 0.0 115.577 179.127 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.384 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 52.0 mtm -69.62 114.81 8.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.469 1.031 . . . . 0.0 109.265 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 49.85 32.01 5.07 Favored 'General case' 0 CA--C 1.557 1.243 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -167.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.2 mt -127.4 -89.05 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.543 1.137 . . . . 0.0 109.253 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 88.3 t -103.09 -79.23 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.726 1.148 . . . . 0.0 111.297 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.5 t -81.74 80.55 8.03 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.61 1.095 . . . . 0.0 112.153 -171.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 45.4 mtt-85 -74.76 99.95 3.88 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 127.107 2.163 . . . . 0.0 111.378 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.63 130.04 12.12 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.539 1.535 . . . . 0.0 112.079 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 58.24 152.66 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.855 2.462 . . . . 0.0 116.116 -173.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 58.13 -161.12 0.24 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.838 0.855 . . . . 0.0 112.852 -167.18 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.57 -166.06 35.51 Favored Glycine 0 C--N 1.344 0.974 0 O-C-N 121.36 -0.838 . . . . 0.0 114.321 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -153.03 -72.99 0.14 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.84 -0.8 . . . . 0.0 112.77 173.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -69.12 0.86 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.578 1.151 . . . . 0.0 112.681 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -141.39 119.12 11.73 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.628 1.571 . . . . 0.0 109.521 -177.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 64.76 -61.75 0.2 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.734 2.414 . . . . 0.0 115.209 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -166.9 -57.04 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.49 2.716 . . . . 0.0 108.434 162.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.72 171.82 13.56 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.925 1.69 . . . . 0.0 112.43 -173.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.33 44.23 0.47 Allowed 'General case' 0 C--O 1.244 0.803 0 C-N-CA 123.948 0.899 . . . . 0.0 111.499 166.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.1 p -142.09 7.77 1.82 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 117.302 2.334 . . . . 0.0 117.302 -163.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -144.2 -143.7 0.15 Allowed 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 120.335 1.425 . . . . 0.0 112.093 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.18 -147.49 31.76 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 119.807 1.185 . . . . 0.0 115.019 172.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 23.7 t 66.84 -27.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 128.588 2.755 . . . . 0.0 115.941 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.39 -176.08 0.15 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.295 1.438 . . . . 0.0 113.932 171.253 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 t -137.95 128.64 26.76 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.271 1.828 . . . . 0.0 107.139 157.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.171 0 CA-C-O 118.828 -0.985 . . . . 0.0 114.989 -172.016 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.538 0.494 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.84 151.47 23.06 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . 58.77 30.47 20.06 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.6 mt -137.85 99.22 9.33 Favored Pre-proline 0 CA--C 1.554 1.123 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo . . . . . 0 CA--C 1.539 0.773 0 C-N-CA 124.298 3.332 . . . . 0.0 112.424 -179.109 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.849 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -56.51 -22.5 33.23 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.393 1.877 . . . . 0.0 114.49 -173.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -116.3 -51.37 2.62 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.48 1.912 . . . . 0.0 111.351 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -160.15 -31.54 0.06 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 176.196 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.2 -144.93 7.56 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 124.071 0.843 . . . . 0.0 112.298 -169.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.3 -177.55 3.53 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.765 2.977 . . . . 0.0 111.436 171.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 m -154.48 -22.42 0.13 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.968 -1.082 . . . . 0.0 113.651 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -148.56 16.96 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 124.333 1.053 . . . . 0.0 111.61 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.7 -153.86 46.31 Favored Glycine 0 CA--C 1.543 1.784 0 O-C-N 119.862 -1.774 . . . . 0.0 112.267 -154.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -91.3 70.77 6.12 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.08 0.952 . . . . 0.0 112.933 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -154.8 71.06 0.79 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.589 1.555 . . . . 0.0 110.049 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 53.0 mt . . . . . 0 N--CA 1.483 1.211 0 C-N-CA 126.508 1.923 . . . . 0.0 109.144 -173.918 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.288 1.1 mp 68.79 148.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.245 2.218 . . . . 0.0 114.047 -176.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 59.67 114.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.049 2.54 . . . . 0.0 115.277 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.316 17.1 pt-20 39.08 -133.72 0.15 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.21 1.804 . . . . 0.0 115.751 -177.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.1 pt -147.45 -68.51 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 125.94 1.696 . . . . 0.0 112.256 -168.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -159.37 -66.13 0.08 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.668 1.187 . . . . 0.0 110.684 -175.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.01 -74.11 0.33 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.633 1.173 . . . . 0.0 111.601 169.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -139.97 160.1 40.68 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.022 1.729 . . . . 0.0 108.423 164.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -161.03 -36.74 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 54.34 15.13 0.9 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.31 -70.25 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 126.484 1.914 . . . . 0.0 111.549 -161.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -147.8 143.19 27.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.27 1.828 . . . . 0.0 109.208 165.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 152.78 -10.36 0.58 Allowed Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.132 0.872 . . . . 0.0 114.761 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -123.15 92.81 3.78 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.965 1.706 . . . . 0.0 110.489 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -165.98 -74.27 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.098 1.759 . . . . 0.0 110.09 165.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.53 -45.73 0.09 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 t -139.38 -122.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 124.824 1.25 . . . . 0.0 109.367 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.1 146.13 13.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.922 1.289 . . . . 0.0 109.365 175.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.465 0 C-N-CA 123.756 0.693 . . . . 0.0 114.356 179.72 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.47 0.535 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -132.68 -44.99 0.88 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.068 1.347 . . . . 0.0 113.67 -172.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -137.92 -73.07 0.41 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.821 1.248 . . . . 0.0 112.758 -172.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.08 118.73 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 129.047 2.939 . . . . 0.0 117.182 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -73.8 -52.47 12.98 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 120.198 -1.564 . . . . 0.0 113.163 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 75.1 m -96.99 12.95 30.63 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 -166.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.295 0.0 OUTLIER 41.8 34.36 0.41 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 128.041 2.536 . . . . 0.0 116.694 175.306 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -163.25 -31.2 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.461 2.305 . . . . 0.0 112.319 176.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.91 -39.69 40.8 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 126.141 1.776 . . . . 0.0 114.815 -171.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -72.65 15.91 0.17 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.658 1.583 . . . . 0.0 114.584 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -144.09 -11.49 0.65 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.431 -1.418 . . . . 0.0 113.586 178.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -54.05 -39.44 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 125.14 1.376 . . . . 0.0 112.62 -173.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.8 p -146.23 -61.76 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.314 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.6 t -162.46 56.8 0.22 Allowed 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.498 1.045 . . . . 0.0 112.319 177.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -114.07 146.31 40.4 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 121.3 -0.875 . . . . 0.0 111.653 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -148.62 120.69 8.27 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.311 1.844 . . . . 0.0 108.982 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.287 1.9 mp0 40.28 -105.33 0.05 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.106 1.762 . . . . 0.0 112.952 -175.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -97.17 -69.29 0.76 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 120.448 1.476 . . . . 0.0 111.12 163.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -134.81 132.03 6.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 124.107 0.861 . . . . 0.0 111.509 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 32.7 m170 44.13 -70.67 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 129.366 3.066 . . . . 0.0 118.455 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.38 -56.46 2.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.812 1.245 . . . . 0.0 110.5 -177.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -144.88 -70.44 0.28 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.075 1.75 . . . . 0.0 112.125 -173.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.93 -69.53 0.84 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.45 1.1 . . . . 0.0 110.61 -174.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.61 -74.65 0.14 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.169 0.987 . . . . 0.0 109.268 162.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -125.86 125.68 43.22 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.77 1.228 . . . . 0.0 112.605 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -163.33 55.76 0.18 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.428 2.291 . . . . 0.0 109.33 168.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -142.31 0.42 1.33 Allowed 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -174.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -138.11 176.29 8.83 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.689 1.595 . . . . 0.0 113.144 -161.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.14 3.42 64.99 Favored Glycine 0 CA--C 1.546 1.97 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 167.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -162.78 134.65 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 119.828 1.814 . . . . 0.0 111.359 171.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.2 p -150.65 161.83 41.84 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.387 1.075 . . . . 0.0 112.905 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -101.31 134.65 44.05 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.931 2.092 . . . . 0.0 108.713 156.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 170.34 169.01 32.96 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.026 1.298 . . . . 0.0 113.809 -177.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -139.31 85.94 14.96 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 126.039 1.736 . . . . 0.0 111.752 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.83 -30.66 26.58 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.787 2.325 . . . . 0.0 114.333 -174.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -106.99 -18.35 13.93 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -175.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 76.8 m -113.18 74.03 1.86 Allowed Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 125.467 1.507 . . . . 0.0 112.293 -178.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.62 37.66 0.37 Allowed 'Trans proline' 0 CA--C 1.556 1.576 0 C-N-CA 124.646 3.564 . . . . 0.0 114.701 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -160.03 20.86 0.16 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.038 1.735 . . . . 0.0 113.057 -172.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m -66.69 -32.47 73.79 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 119.917 -1.74 . . . . 0.0 114.184 -171.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? 56.29 -167.22 0.11 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.411 1.485 . . . . 0.0 111.62 -160.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.68 165.36 3.94 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.83 1.252 . . . . 0.0 112.718 171.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mm -48.38 118.86 7.16 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.152 0.981 . . . . 0.0 111.922 -173.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -68.92 140.43 45.88 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.535 1.49 . . . . 0.0 110.142 174.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -122.59 75.02 1.23 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.315 1.846 . . . . 0.0 106.662 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -71.09 -18.32 62.54 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 -158.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -100.39 6.22 44.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.542 1.937 . . . . 0.0 111.95 172.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -152.39 50.21 0.77 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.696 1.998 . . . . 0.0 110.605 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.57 5.29 11.25 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.639 1.576 . . . . 0.0 113.676 177.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.79 -0.35 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 130.967 3.707 . . . . 0.0 116.552 -173.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.1 tptm -128.13 6.12 5.91 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.498 1.919 . . . . 0.0 113.801 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.63 -40.4 0.2 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -172.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.84 158.59 51.42 Favored Glycine 0 N--CA 1.473 1.163 0 O-C-N 121.342 -0.849 . . . . 0.0 114.343 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -74.1 -9.78 22.27 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 124.189 3.259 . . . . 0.0 112.748 171.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.2 p -74.76 160.29 30.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.314 1.446 . . . . 0.0 111.752 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 52.0 mt 70.93 143.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.344 1.857 . . . . 0.0 114.136 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 89.11 156.29 31.46 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.665 1.602 . . . . 0.0 115.579 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -68.02 80.56 0.22 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 123.319 1.533 . . . . 0.0 111.488 171.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.8 tptt -86.02 4.94 35.71 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.163 1.385 . . . . 0.0 111.718 160.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -82.64 -74.72 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.434 0.694 . . . . 0.0 110.344 -155.032 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -121.88 -20.38 6.4 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -171.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.0 -0.48 14.75 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.621 1.168 . . . . 0.0 111.784 -177.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -78.38 -176.26 46.65 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.173 1.368 . . . . 0.0 114.353 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -122.3 53.46 1.23 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.871 1.269 . . . . 0.0 111.263 -167.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.92 -18.0 0.22 Allowed 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 116.955 2.206 . . . . 0.0 116.955 -175.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 54.54 85.08 0.06 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.015 1.726 . . . . 0.0 115.544 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 39.4 mt -133.29 -48.13 0.84 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.987 1.715 . . . . 0.0 112.523 170.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.282 0.2 OUTLIER 57.64 177.17 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 126.04 1.736 . . . . 0.0 113.723 -169.374 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 68.0 117.76 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.953 2.101 . . . . 0.0 116.637 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.362 7.8 pt-20 38.56 -94.43 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 128.559 2.744 . . . . 0.0 115.667 -176.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.3 mt -152.93 -53.2 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.892 1.677 . . . . 0.0 109.376 167.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -161.72 -56.72 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.87 2.068 . . . . 0.0 108.346 -174.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -156.92 49.39 0.46 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 127.297 2.239 . . . . 0.0 110.93 172.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.4 t70 55.1 36.2 26.44 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 169.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -67.5 -47.88 68.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 119.296 -2.128 . . . . 0.0 114.375 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -99.58 -3.3 33.62 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -166.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.3 mt 53.95 -95.61 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.597 1.559 . . . . 0.0 112.814 -172.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -146.51 149.58 33.91 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.691 1.996 . . . . 0.0 111.676 -172.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.09 -9.87 0.02 OUTLIER Glycine 0 N--CA 1.478 1.461 0 N-CA-C 116.288 1.275 . . . . 0.0 116.288 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -133.15 5.36 3.82 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.472 2.309 . . . . 0.0 114.609 -163.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -79.09 0.43 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.056 1.342 . . . . 0.0 111.605 172.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 t -136.37 -55.34 0.75 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.869 -1.144 . . . . 0.0 113.639 -175.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . 0.291 6.3 t 60.35 -96.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 127.336 2.254 . . . . 0.0 113.663 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.409 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER -166.83 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.845 1.258 . . . . 0.0 111.211 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.409 ' H ' ' HB3' ' A' ' 87' ' ' PHE . . . -72.22 -168.61 11.2 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 125.618 1.58 . . . . 0.0 115.701 176.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 167.12 -153.1 22.44 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.706 1.146 . . . . 0.0 112.327 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -74.38 62.84 2.23 Favored Glycine 0 N--CA 1.472 1.074 0 C-N-CA 125.22 1.39 . . . . 0.0 114.927 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -145.57 110.84 5.3 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.295 1.038 . . . . 0.0 110.65 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -137.05 -155.49 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 126.324 1.85 . . . . 0.0 111.043 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.9 tp . . . . . 0 N--CA 1.485 1.282 0 C-N-CA 127.379 2.272 . . . . 0.0 113.806 -167.65 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.7 p . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 119.802 -0.142 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 53.2 t30 60.32 -67.52 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 129.234 3.013 . . . . 0.0 114.453 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -131.56 -45.79 0.98 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.396 1.479 . . . . 0.0 111.544 177.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 64.33 127.18 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 128.601 2.76 . . . . 0.0 116.52 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -134.31 -89.97 0.36 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.782 2.033 . . . . 0.0 108.849 174.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.5 m -77.4 63.69 2.62 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.183 1.793 . . . . 0.0 111.414 -175.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 23.94 75.87 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 128.599 2.759 . . . . 0.0 113.723 169.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 58.4 1.64 0.18 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.33 -38.17 35.81 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 121.392 1.905 . . . . 0.0 111.826 168.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 ptm -54.99 -29.22 56.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -165.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.01 -9.02 15.72 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.172 1.389 . . . . 0.0 112.349 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -105.5 -41.84 6.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 125.245 1.418 . . . . 0.0 111.728 -166.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.3 t -121.9 118.66 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.326 1.45 . . . . 0.0 109.55 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.8 t 61.13 -36.86 0.1 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 129.266 3.026 . . . . 0.0 117.726 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.73 125.04 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 1 C-N-CA 131.755 4.022 . . . . 0.0 116.664 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.9 mmt-85 -146.02 -125.74 0.07 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 127.921 2.488 . . . . 0.0 108.285 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -165.32 -174.73 3.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.621 2.768 . . . . 0.0 108.184 -174.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 55.72 -119.04 1.32 Allowed 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.23 -1.367 . . . . 0.0 111.949 -176.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 56.5 -166.63 4.32 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.47 1.986 . . . . 0.0 115.669 176.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -157.17 -39.52 0.07 Allowed 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 173.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.67 -84.57 0.47 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.745 1.618 . . . . 0.0 113.574 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -112.87 -112.19 0.34 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.882 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.61 -60.07 3.81 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.882 1.674 . . . . 0.0 112.379 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -170.33 -55.55 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 128.604 2.762 . . . . 0.0 109.442 172.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -159.23 106.19 1.75 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.425 1.89 . . . . 0.0 109.803 -152.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.78 -13.03 0.11 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -168.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.7 p -104.65 38.1 1.98 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -170.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -152.34 178.92 9.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.73 1.212 . . . . 0.0 112.134 -172.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.79 6.37 67.56 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 116.681 1.433 . . . . 0.0 116.681 167.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.252 20.0 m -106.52 -59.0 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.566 1.683 . . . . 0.0 114.544 -170.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.74 139.83 18.35 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.646 1.566 . . . . 0.0 111.626 -178.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -106.35 154.9 20.12 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.698 1.199 . . . . 0.0 113.683 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 90.72 -173.31 38.24 Favored Glycine 0 N--CA 1.478 1.461 0 C-N-CA 124.743 1.163 . . . . 0.0 112.854 -169.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -76.92 128.85 80.42 Favored Pre-proline 0 CA--C 1.549 0.915 0 O-C-N 121.61 -0.935 . . . . 0.0 112.527 -163.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -96.17 -51.14 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 123.673 2.915 . . . . 0.0 113.845 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -108.69 33.23 4.32 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 126.038 1.735 . . . . 0.0 110.304 -177.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -147.75 153.93 43.42 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 125.82 1.648 . . . . 0.0 111.969 -175.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -77.54 3.26 6.98 Favored 'Trans proline' 0 C--O 1.238 0.477 0 C-N-CA 123.474 2.782 . . . . 0.0 115.663 -163.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.54 -32.02 53.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.676 1.191 . . . . 0.0 112.639 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 53.85 -147.57 0.49 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 126.331 1.853 . . . . 0.0 113.813 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -156.22 178.2 10.56 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 128.253 2.621 . . . . 0.0 109.649 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.15 82.98 0.13 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 40.6 mm -115.94 72.58 4.43 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 126.535 1.934 . . . . 0.0 108.108 174.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -62.48 148.35 93.44 Favored 'Trans proline' 0 C--O 1.244 0.796 0 C-N-CA 122.77 2.313 . . . . 0.0 113.207 -169.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -74.26 65.6 1.2 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.062 1.745 . . . . 0.0 112.05 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -51.14 -35.86 37.9 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.636 1.574 . . . . 0.0 113.28 -176.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -95.97 -4.75 42.71 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.134 1.373 . . . . 0.0 113.439 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -147.51 25.05 1.09 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -168.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.52 54.58 1.78 Allowed 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.217 -1.552 . . . . 0.0 110.41 172.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -84.47 -11.89 55.32 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.359 1.464 . . . . 0.0 113.812 -178.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -122.46 162.76 21.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.587 2.355 . . . . 0.0 110.79 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 70.67 -37.64 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 169.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -86.74 -55.11 2.49 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.356 1.455 . . . . 0.0 114.563 172.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -79.23 -166.39 0.41 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.753 2.969 . . . . 0.0 112.1 176.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -63.26 152.33 38.01 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.073 -1.017 . . . . 0.0 111.369 158.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . 0.311 0.1 OUTLIER 73.73 152.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 129.532 3.133 . . . . 0.0 115.518 -171.356 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.82 5.02 73.33 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 118.619 2.207 . . . . 0.0 118.619 163.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -81.57 -104.71 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.883 2.341 . . . . 0.0 111.623 168.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -81.02 -5.5 57.68 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 -157.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.425 HG13 ' H ' ' A' ' 63' ' ' ILE . 6.9 mt -32.23 -51.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 129.094 2.958 . . . . 0.0 114.57 -170.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -139.98 -25.51 0.8 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.21 1.404 . . . . 0.0 112.349 162.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -90.9 26.21 2.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.666 1.587 . . . . 0.0 112.207 -177.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -76.43 -162.12 13.14 Favored Glycine 0 CA--C 1.536 1.35 0 CA-C-O 121.992 0.773 . . . . 0.0 112.009 164.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -137.82 -35.54 0.64 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.923 1.289 . . . . 0.0 112.025 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.0 t -93.83 -25.08 17.51 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 174.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.84 166.81 11.29 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -162.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.6 mt -92.6 -92.04 0.16 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -167.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 tt -158.93 167.35 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.437 1.495 . . . . 0.0 110.689 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 75.78 117.87 0.06 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 128.847 2.859 . . . . 0.0 113.853 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.293 4.1 pt-20 40.53 -146.47 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.61 2.764 . . . . 0.0 116.149 174.027 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 39.5 mm -120.37 -70.49 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -129.99 -34.97 1.65 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.565 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt 179.68 83.07 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 126.752 2.021 . . . . 0.0 109.09 170.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -149.47 145.27 26.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -160.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -65.92 -9.84 33.26 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 165.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 65.68 5.75 3.5 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tt 65.81 115.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.538 2.335 . . . . 0.0 113.643 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.2 t80 67.5 130.77 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.439 1.896 . . . . 0.0 113.575 -175.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 131.9 -125.26 4.25 Favored Glycine 0 N--CA 1.473 1.142 0 O-C-N 121.083 -1.011 . . . . 0.0 110.805 -165.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -59.83 62.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 128.788 2.835 . . . . 0.0 112.185 169.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -167.09 -39.95 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.845 2.058 . . . . 0.0 110.585 -162.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.8 t -164.3 -46.62 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 173.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 t 45.1 -105.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 126.463 1.905 . . . . 0.0 113.952 -170.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -166.29 154.5 10.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.244 2.218 . . . . 0.0 109.35 -173.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -166.03 -171.0 31.68 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 115.006 0.763 . . . . 0.0 115.006 175.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -161.57 -160.06 10.58 Favored Glycine 0 CA--C 1.54 1.627 0 C-N-CA 125.901 1.715 . . . . 0.0 112.901 -176.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 119.06 71.04 0.35 Allowed Glycine 0 CA--C 1.538 1.481 0 C-N-CA 123.945 0.783 . . . . 0.0 113.175 174.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -138.4 135.84 35.68 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.389 1.476 . . . . 0.0 111.255 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 59.4 t -103.23 33.52 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 125.813 1.645 . . . . 0.0 112.252 -176.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.8 mp . . . . . 0 C--O 1.255 1.383 0 C-N-CA 127.12 2.168 . . . . 0.0 108.84 170.13 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.1 t . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.6 m120 58.86 -69.52 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 127.504 2.321 . . . . 0.0 115.726 173.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -134.4 -65.8 0.63 Allowed 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 127.852 2.461 . . . . 0.0 108.621 171.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 54.98 141.12 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 128.406 2.682 . . . . 0.0 116.596 -176.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -76.48 -95.14 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.646 1.178 . . . . 0.0 111.396 170.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.5 m -78.07 52.5 1.09 Allowed 'General case' 0 CA--C 1.542 0.659 0 O-C-N 120.699 -1.251 . . . . 0.0 114.249 -170.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 17.41 77.05 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 128.668 2.787 . . . . 0.0 116.903 166.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 54.19 24.59 5.04 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.437 ' HA ' ' H ' ' A' ' 16' ' ' VAL . . . -111.19 -27.48 8.68 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.869 2.068 . . . . 0.0 113.735 175.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ptp -58.1 86.02 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 127.238 2.215 . . . . 0.0 115.224 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 62.17 37.01 14.68 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 112.14 -167.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.1 mt -129.64 -76.56 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 125.375 1.47 . . . . 0.0 109.395 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.437 ' H ' ' HA ' ' A' ' 12' ' ' ALA . 0.3 OUTLIER -100.32 -32.39 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.03 0.932 . . . . 0.0 112.746 -179.715 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.6 t -167.95 111.41 0.63 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.869 1.268 . . . . 0.0 109.581 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . 0.313 1.7 ppt_? -81.38 133.08 35.37 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 119.839 1.199 . . . . 0.0 113.574 176.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ttt-85 -149.72 -161.82 1.43 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 128.051 2.541 . . . . 0.0 107.73 171.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 66.88 156.93 0.11 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 167.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.97 -158.17 0.33 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.351 1.06 . . . . 0.0 110.994 -165.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.28 19.73 59.99 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 119.954 1.252 . . . . 0.0 115.113 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 26.8 m170 61.27 -43.8 0.13 Allowed 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 128.817 2.847 . . . . 0.0 115.35 -171.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 -67.66 0.88 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.977 1.711 . . . . 0.0 113.236 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -140.0 -90.89 0.17 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.523 1.129 . . . . 0.0 113.074 -175.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -87.46 -57.19 3.04 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.421 1.009 . . . . 0.0 110.511 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -171.6 -67.18 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 128.438 2.695 . . . . 0.0 106.586 161.045 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -105.73 165.93 10.82 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.717 2.007 . . . . 0.0 111.86 -175.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.28 9.12 5.39 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 118.808 2.892 . . . . 0.0 118.808 166.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.5 m -111.72 44.8 1.31 Allowed 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 119.771 1.169 . . . . 0.0 113.587 175.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.82 162.52 34.76 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.721 -1.237 . . . . 0.0 113.942 170.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.38 8.76 70.64 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 126.089 1.804 . . . . 0.0 114.563 -176.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -155.81 152.87 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 126.256 1.823 . . . . 0.0 110.128 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.1 151.78 28.71 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.518 2.327 . . . . 0.0 109.172 165.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.39 166.29 13.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.883 0.873 . . . . 0.0 110.434 162.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 153.73 105.1 0.25 Allowed Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 177.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -115.62 75.24 4.96 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -167.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -63.11 -30.1 75.08 Favored 'Trans proline' 0 C--N 1.36 1.16 0 C-N-CA 123.883 3.056 . . . . 0.0 113.628 -177.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -103.39 -3.79 25.0 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.163 1.385 . . . . 0.0 113.018 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.1 m -135.0 59.18 32.44 Favored Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 124.619 1.168 . . . . 0.0 112.138 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -65.61 -37.28 29.68 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.536 2.158 . . . . 0.0 113.937 -174.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.73 24.47 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 167.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 p -81.45 159.39 24.27 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -167.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.95 167.64 9.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.109 1.364 . . . . 0.0 111.889 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 166.35 2.43 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.8 1.24 . . . . 0.0 113.306 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.9 mt -110.43 79.81 1.8 Allowed Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 124.455 1.102 . . . . 0.0 110.044 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -75.01 165.44 31.31 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.083 2.522 . . . . 0.0 110.526 164.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -87.02 102.35 14.32 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -84.46 2.21 41.95 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.564 1.145 . . . . 0.0 113.699 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -145.29 3.9 1.04 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.567 1.547 . . . . 0.0 112.828 -164.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -168.4 172.7 8.15 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 129.555 3.142 . . . . 0.0 107.203 -174.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -144.67 40.61 1.3 Allowed 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 121.526 1.966 . . . . 0.0 115.428 -170.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.01 33.2 0.08 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 115.69 1.737 . . . . 0.0 115.69 -166.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -158.34 138.85 12.68 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.256 1.822 . . . . 0.0 108.432 170.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 67.32 -35.83 0.27 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -80.36 123.78 6.21 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-N 120.305 1.411 . . . . 0.0 112.307 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -81.12 -41.07 0.15 Allowed 'Trans proline' 0 C--N 1.362 1.242 0 C-N-CA 122.481 2.121 . . . . 0.0 111.787 177.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.2 p -69.61 172.95 6.6 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.701 1.6 . . . . 0.0 110.527 167.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 68.6 mt 67.41 -67.64 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.539 1.535 . . . . 0.0 110.22 -165.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 164.14 100.4 0.15 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 123.63 0.633 . . . . 0.0 114.065 170.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.77 -49.44 25.41 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.92 0.488 . . . . 0.0 111.405 173.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -146.0 95.44 2.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.01 0.924 . . . . 0.0 112.167 170.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.1 pp -136.73 -124.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 126.159 1.784 . . . . 0.0 110.344 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 26.7 mtp180 -58.55 -38.53 78.0 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 126.159 1.784 . . . . 0.0 113.603 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.22 45.41 1.07 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.506 1.122 . . . . 0.0 110.112 175.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -97.43 -108.65 2.64 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 125.157 1.36 . . . . 0.0 111.167 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -160.49 -55.75 0.05 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.164 1.385 . . . . 0.0 109.488 174.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -155.38 39.7 0.4 Allowed 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 122.625 1.202 . . . . 0.0 112.303 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -93.0 -168.38 1.92 Allowed 'General case' 0 CA--C 1.555 1.148 0 O-C-N 120.599 -1.313 . . . . 0.0 111.862 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.61 27.01 0.54 Allowed 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -169.181 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.447 HG12 ' H ' ' A' ' 72' ' ' ALA 0.318 5.4 tt 49.12 -153.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 127.542 2.337 . . . . 0.0 113.044 176.186 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.447 ' H ' HG12 ' A' ' 71' ' ' ILE . . . 41.12 103.88 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 128.948 2.899 . . . . 0.0 117.013 173.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -68.9 175.4 3.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.545 -1.347 . . . . 0.0 113.043 168.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 10.5 mm -50.39 -53.41 12.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.653 1.181 . . . . 0.0 112.715 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -150.36 -60.66 0.19 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.178 1.791 . . . . 0.0 111.515 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -161.44 48.67 0.21 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 125.646 1.578 . . . . 0.0 112.591 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . 0.32 0.0 OUTLIER 63.79 -42.39 0.24 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.143 2.177 . . . . 0.0 116.075 -174.589 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -66.94 28.32 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 55.73 -25.69 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 130.879 3.671 . . . . 0.0 118.836 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.1 tt -142.65 -53.12 0.4 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.785 1.634 . . . . 0.0 111.271 -174.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -163.22 -40.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 167.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -168.83 -40.78 0.03 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.08 0.848 . . . . 0.0 113.87 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.35 166.02 30.26 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.468 2.307 . . . . 0.0 109.356 171.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.12 -35.21 7.69 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.7 t -146.99 -73.46 0.21 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.6 t 66.79 152.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 127.166 2.186 . . . . 0.0 113.889 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.259 0.2 OUTLIER 63.0 -142.41 0.37 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.534 1.534 . . . . 0.0 113.057 177.541 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.93 -158.92 19.61 Favored Glycine 0 CA--C 1.533 1.214 0 O-C-N 120.21 -1.556 . . . . 0.0 114.842 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 153.89 -169.09 32.44 Favored Glycine 0 CA--C 1.543 1.833 0 C-N-CA 124.523 1.058 . . . . 0.0 113.883 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 167.23 103.72 0.17 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 123.833 0.73 . . . . 0.0 112.714 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -141.29 120.81 13.25 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.19 1.396 . . . . 0.0 110.59 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 1.7 t -123.61 23.97 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 125.76 1.624 . . . . 0.0 111.714 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mp . . . . . 0 C--O 1.244 0.787 0 C-N-CA 126.652 1.981 . . . . 0.0 108.788 173.117 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 39.4 t30 58.08 -60.91 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 128.328 2.651 . . . . 0.0 116.536 -173.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -141.61 149.11 40.28 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.764 1.165 . . . . 0.0 111.887 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 44.9 -144.43 0.16 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.063 1.345 . . . . 0.0 111.765 -166.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -162.82 -43.92 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.962 -1.086 . . . . 0.0 112.508 160.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 58.9 m -91.79 11.84 23.39 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.824 1.25 . . . . 0.0 112.655 -176.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.313 0.0 OUTLIER 49.49 -11.48 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 131.434 3.894 . . . . 0.0 120.867 173.327 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.35 -18.25 9.26 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.338 1.855 . . . . 0.0 112.823 166.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.98 0.07 0.99 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 -176.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 51.3 mtm -83.63 3.61 32.05 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.923 -1.111 . . . . 0.0 113.551 165.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -148.35 8.48 0.81 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 116.017 1.858 . . . . 0.0 116.017 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.3 mm -59.96 -42.26 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.733 -1.229 . . . . 0.0 113.671 -172.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.74 -71.36 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.869 0.867 . . . . 0.0 110.692 169.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -154.51 85.17 1.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.552 1.069 . . . . 0.0 111.979 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.2 mmt-85 -136.99 146.11 44.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.276 1.83 . . . . 0.0 110.222 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.64 -96.87 0.06 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 127.019 2.127 . . . . 0.0 106.405 149.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -132.51 -62.71 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.096 1.359 . . . . 0.0 111.55 161.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -154.79 173.35 16.58 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.086 2.154 . . . . 0.0 111.228 -177.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.1 -171.13 7.95 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.303 -0.873 . . . . 0.0 112.959 -169.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -143.65 -28.81 0.52 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.67 -99.19 0.45 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.872 1.269 . . . . 0.0 111.229 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -111.29 -104.56 0.38 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.434 1.494 . . . . 0.0 111.599 -167.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -73.12 -54.3 8.84 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.625 1.102 . . . . 0.0 110.956 177.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.08 -56.44 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.337 1.855 . . . . 0.0 110.497 157.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -131.69 108.84 9.76 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.417 1.487 . . . . 0.0 111.575 -164.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -165.37 47.36 0.09 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.088 0.955 . . . . 0.0 112.868 -175.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.1 p -155.13 6.65 0.25 Allowed 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 116.825 2.158 . . . . 0.0 116.825 -171.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.29 -170.8 3.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.255 1.422 . . . . 0.0 110.799 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.86 7.21 88.44 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 115.966 1.146 . . . . 0.0 115.966 170.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.26 19.7 m 48.76 83.09 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 127.952 2.501 . . . . 0.0 113.54 -177.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -57.4 147.29 26.58 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.051 1.34 . . . . 0.0 114.12 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 129.87 55.15 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.367 1.467 . . . . 0.0 109.823 -175.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 178.46 71.29 0.06 OUTLIER Glycine 0 CA--C 1.522 0.494 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -171.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -130.64 51.9 8.44 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 126.051 1.74 . . . . 0.0 111.744 -167.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -62.52 -34.07 76.58 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.859 3.04 . . . . 0.0 114.086 -170.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -98.88 1.88 46.14 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.433 1.893 . . . . 0.0 112.537 173.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 73.2 m -125.71 38.72 0.42 Allowed Pre-proline 0 CA--C 1.554 1.124 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 -170.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.78 -21.25 64.85 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.94 2.427 . . . . 0.0 114.83 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -154.32 39.32 0.45 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.566 1.075 . . . . 0.0 113.205 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.2 m -63.43 145.01 56.47 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.086 -1.009 . . . . 0.0 111.773 -170.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -170.06 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.254 1.822 . . . . 0.0 112.86 -176.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.26 156.77 0.15 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.563 1.145 . . . . 0.0 113.114 174.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.8 mp -102.04 86.54 0.88 Allowed Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 167.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -74.9 -171.94 1.11 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.275 2.65 . . . . 0.0 110.984 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -67.66 64.71 0.08 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.771 1.229 . . . . 0.0 111.168 167.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -48.54 -42.42 33.26 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 120.108 1.322 . . . . 0.0 113.601 -177.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -74.45 -20.35 60.05 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.668 1.187 . . . . 0.0 113.973 177.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -140.81 46.27 1.77 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.465 1.906 . . . . 0.0 110.673 -168.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.97 -120.92 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.873 1.269 . . . . 0.0 110.413 -174.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 61.78 -50.42 0.14 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.299 2.64 . . . . 0.0 117.044 173.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.3 138.88 58.68 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.759 2.423 . . . . 0.0 111.521 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 62.05 -49.59 0.16 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 128.275 2.63 . . . . 0.0 116.165 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -124.11 96.43 0.53 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.012 1.768 . . . . 0.0 110.404 170.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.17 55.54 4.07 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 124.331 3.354 . . . . 0.0 111.341 169.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.12 158.13 19.23 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.181 2.592 . . . . 0.0 110.892 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.8 mt 58.54 52.46 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 122.697 1.236 . . . . 0.0 110.567 -160.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.43 136.26 12.61 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 125.26 1.41 . . . . 0.0 111.813 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -97.42 -19.74 18.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.459 1.504 . . . . 0.0 113.236 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.23 53.02 0.96 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.15 1.38 . . . . 0.0 112.361 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.8 mm -114.86 -100.05 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 127.234 2.213 . . . . 0.0 108.768 -174.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -95.13 -14.66 23.98 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 177.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.83 12.66 22.84 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.449 1.5 . . . . 0.0 111.558 165.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -72.56 -119.63 0.06 OUTLIER Glycine 0 CA--C 1.531 1.093 0 C-N-CA 125.497 1.523 . . . . 0.0 112.726 174.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -155.44 -58.3 0.1 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.175 0.99 . . . . 0.0 110.021 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.7 t -147.29 31.81 0.91 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 122.252 1.025 . . . . 0.0 112.637 170.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -77.1 -178.63 5.12 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.84 1.256 . . . . 0.0 111.604 175.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.4 mt -74.63 16.13 0.3 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -167.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.278 1.5 tp 57.06 -163.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 125.949 1.7 . . . . 0.0 114.839 166.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 65.7 -125.1 0.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -124.23 159.38 30.29 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.197 2.199 . . . . 0.0 112.397 -168.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.2 mt -73.72 -40.89 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.247 -0.908 . . . . 0.0 112.092 -170.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -49.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.851 1.26 . . . . 0.0 110.136 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -164.81 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.517 1.527 . . . . 0.0 113.007 170.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.52 38.23 0.54 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.901 0.88 . . . . 0.0 113.084 -175.125 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -74.19 -67.64 0.6 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -172.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.88 -0.55 31.19 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.163 1.347 . . . . 0.0 114.071 -176.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.1 mt 56.35 -177.23 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.017 1.327 . . . . 0.0 111.9 -160.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 45.35 -149.79 0.08 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.609 1.964 . . . . 0.0 114.845 177.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 73.04 34.51 58.51 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.2 -0.937 . . . . 0.0 113.385 -175.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -138.51 141.02 39.38 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.976 1.71 . . . . 0.0 110.804 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -78.2 -36.23 47.55 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -169.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -156.37 -53.12 0.08 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 -170.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 56.83 1.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 127.491 2.316 . . . . 0.0 115.714 -177.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.07 150.96 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.141 2.177 . . . . 0.0 114.477 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -164.52 -176.51 36.35 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 115.577 0.991 . . . . 0.0 115.577 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 173.77 174.26 40.57 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 127.076 2.274 . . . . 0.0 111.443 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 162.37 86.6 0.06 OUTLIER Glycine 0 CA--C 1.534 1.279 0 CA-C-N 117.708 0.754 . . . . 0.0 113.465 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -149.24 146.06 27.41 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.44 1.096 . . . . 0.0 112.61 -175.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -141.9 -153.35 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 126.395 1.878 . . . . 0.0 109.764 173.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 96.7 mt . . . . . 0 N--CA 1.484 1.252 0 C-N-CA 127.485 2.314 . . . . 0.0 111.31 -171.275 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.4 m-20 51.86 -111.44 0.57 Allowed 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 125.137 1.375 . . . . 0.0 110.932 -173.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -74.93 -54.29 7.48 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.977 1.262 . . . . 0.0 113.444 174.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.07 100.35 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.739 2.016 . . . . 0.0 115.021 -159.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -94.95 -30.25 14.24 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.258 1.423 . . . . 0.0 112.526 174.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 71.0 m -102.67 -0.4 31.84 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.539 1.936 . . . . 0.0 113.432 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.26 0.0 OUTLIER 46.73 43.54 13.02 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.049 2.14 . . . . 0.0 115.134 171.232 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 60.65 71.83 0.55 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.775 2.43 . . . . 0.0 113.97 -176.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -134.15 -44.01 0.79 Allowed 'General case' 0 C--N 1.348 0.528 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -171.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 52.0 mtm -69.62 114.81 8.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.469 1.031 . . . . 0.0 109.265 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 49.85 32.01 5.07 Favored 'General case' 0 CA--C 1.557 1.243 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -167.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.2 mt -127.4 -89.05 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.543 1.137 . . . . 0.0 109.253 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 88.3 t -103.09 -79.23 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.726 1.148 . . . . 0.0 111.297 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.5 t -81.74 80.55 8.03 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.61 1.095 . . . . 0.0 112.153 -171.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 45.4 mtt-85 -74.76 99.95 3.88 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 127.107 2.163 . . . . 0.0 111.378 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.63 130.04 12.12 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.539 1.535 . . . . 0.0 112.079 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 58.24 152.66 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.855 2.462 . . . . 0.0 116.116 -173.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 58.13 -161.12 0.24 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.838 0.855 . . . . 0.0 112.852 -167.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.57 -166.06 35.51 Favored Glycine 0 C--N 1.344 0.974 0 O-C-N 121.36 -0.838 . . . . 0.0 114.321 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -153.03 -72.99 0.14 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.84 -0.8 . . . . 0.0 112.77 173.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -69.12 0.86 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.578 1.151 . . . . 0.0 112.681 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -141.39 119.12 11.73 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.628 1.571 . . . . 0.0 109.521 -177.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 64.76 -61.75 0.2 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.734 2.414 . . . . 0.0 115.209 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -166.9 -57.04 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.49 2.716 . . . . 0.0 108.434 162.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.72 171.82 13.56 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.925 1.69 . . . . 0.0 112.43 -173.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.33 44.23 0.47 Allowed 'General case' 0 C--O 1.244 0.803 0 C-N-CA 123.948 0.899 . . . . 0.0 111.499 166.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.1 p -142.09 7.77 1.82 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 117.302 2.334 . . . . 0.0 117.302 -163.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -144.2 -143.7 0.15 Allowed 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 120.335 1.425 . . . . 0.0 112.093 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.18 -147.49 31.76 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 119.807 1.185 . . . . 0.0 115.019 172.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 23.7 t 66.84 -27.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 128.588 2.755 . . . . 0.0 115.941 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.39 -176.08 0.15 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.295 1.438 . . . . 0.0 113.932 171.253 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 t -137.95 128.64 26.76 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.271 1.828 . . . . 0.0 107.139 157.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 176.44 55.08 0.06 OUTLIER Glycine 0 CA--C 1.533 1.171 0 CA-C-O 118.828 -0.985 . . . . 0.0 114.989 -172.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.17 111.73 26.83 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 124.764 1.226 . . . . 0.0 111.706 173.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -86.35 -31.11 0.32 Allowed 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.723 2.949 . . . . 0.0 114.577 174.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -119.39 -25.77 5.98 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.66 1.184 . . . . 0.0 113.132 -173.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 95.2 m -73.37 160.46 82.44 Favored Pre-proline 0 CA--C 1.558 1.288 0 C-N-CA 123.842 0.857 . . . . 0.0 111.519 170.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -80.1 61.5 8.22 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.483 2.788 . . . . 0.0 113.522 -173.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -136.3 43.36 2.49 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.203 -0.935 . . . . 0.0 111.952 176.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 m -50.33 125.27 12.22 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.542 1.537 . . . . 0.0 112.942 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.84 151.47 23.06 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . 58.77 30.47 20.06 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.6 mt -137.85 99.22 9.33 Favored Pre-proline 0 CA--C 1.554 1.123 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.81 60.33 6.69 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 124.298 3.332 . . . . 0.0 112.424 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.73 49.72 0.32 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.004 1.721 . . . . 0.0 113.675 -178.589 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.23 -22.36 66.92 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 120.134 -1.603 . . . . 0.0 112.13 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -89.54 -2.36 58.32 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 176.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -153.43 157.83 40.51 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 120.774 1.624 . . . . 0.0 113.894 -173.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.97 36.92 25.62 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -56.51 -22.5 33.23 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.393 1.877 . . . . 0.0 114.49 -173.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -116.3 -51.37 2.62 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.48 1.912 . . . . 0.0 111.351 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -160.15 -31.54 0.06 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 176.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.2 -144.93 7.56 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 124.071 0.843 . . . . 0.0 112.298 -169.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.3 -177.55 3.53 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.765 2.977 . . . . 0.0 111.436 171.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 m -154.48 -22.42 0.13 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.968 -1.082 . . . . 0.0 113.651 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -148.56 16.96 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 124.333 1.053 . . . . 0.0 111.61 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.7 -153.86 46.31 Favored Glycine 0 CA--C 1.543 1.784 0 O-C-N 119.862 -1.774 . . . . 0.0 112.267 -154.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -91.3 70.77 6.12 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.08 0.952 . . . . 0.0 112.933 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -154.8 71.06 0.79 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.589 1.555 . . . . 0.0 110.049 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 53.0 mt -150.44 -57.92 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 126.508 1.923 . . . . 0.0 109.144 -173.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 16.6 mtm180 -136.51 13.16 3.23 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.725 2.01 . . . . 0.0 111.379 160.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -125.1 -3.26 7.58 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.37 1.868 . . . . 0.0 113.948 -158.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -75.3 -95.86 0.14 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-N 119.295 0.952 . . . . 0.0 111.103 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -150.06 -39.53 0.14 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.475 1.11 . . . . 0.0 112.417 164.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 52.1 m -140.51 79.29 1.7 Allowed 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 122.55 1.166 . . . . 0.0 109.046 174.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -84.23 161.95 20.34 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.193 1.397 . . . . 0.0 111.02 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.82 -7.96 55.73 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 175.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.288 1.1 mp 68.79 148.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.245 2.218 . . . . 0.0 114.047 -176.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 59.67 114.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.049 2.54 . . . . 0.0 115.277 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.316 17.1 pt-20 39.08 -133.72 0.15 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.21 1.804 . . . . 0.0 115.751 -177.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.1 pt -147.45 -68.51 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 125.94 1.696 . . . . 0.0 112.256 -168.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -159.37 -66.13 0.08 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.668 1.187 . . . . 0.0 110.684 -175.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.01 -74.11 0.33 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.633 1.173 . . . . 0.0 111.601 169.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -139.97 160.1 40.68 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.022 1.729 . . . . 0.0 108.423 164.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -161.03 -36.74 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 54.34 15.13 0.9 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.31 -70.25 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 126.484 1.914 . . . . 0.0 111.549 -161.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -147.8 143.19 27.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.27 1.828 . . . . 0.0 109.208 165.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 152.78 -10.36 0.58 Allowed Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.132 0.872 . . . . 0.0 114.761 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -123.15 92.81 3.78 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.965 1.706 . . . . 0.0 110.489 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -165.98 -74.27 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.098 1.759 . . . . 0.0 110.09 165.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.53 -45.73 0.09 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 t -139.38 -122.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 124.824 1.25 . . . . 0.0 109.367 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.1 146.13 13.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.922 1.289 . . . . 0.0 109.365 175.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -165.18 -178.07 38.11 Favored Glycine 0 N--CA 1.478 1.465 0 C-N-CA 123.756 0.693 . . . . 0.0 114.356 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 179.87 58.76 0.08 OUTLIER Glycine 0 CA--C 1.533 1.191 0 N-CA-C 116.24 1.256 . . . . 0.0 116.24 -174.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -157.34 -166.94 17.67 Favored Glycine 0 N--CA 1.478 1.452 0 C-N-CA 124.494 1.045 . . . . 0.0 113.721 173.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.41 141.75 20.61 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 118.171 0.986 . . . . 0.0 112.781 162.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 93.7 t -94.14 158.8 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.9 1.68 . . . . 0.0 109.014 158.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.3 tp . . . . . 0 N--CA 1.482 1.125 0 C-N-CA 127.501 2.32 . . . . 0.0 114.975 -174.087 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.085 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -72.65 15.91 0.17 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.658 1.583 . . . . 0.0 114.584 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -144.09 -11.49 0.65 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.431 -1.418 . . . . 0.0 113.586 178.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -54.05 -39.44 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 125.14 1.376 . . . . 0.0 112.62 -173.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.8 p -146.23 -61.76 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.314 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.6 t -162.46 56.8 0.22 Allowed 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.498 1.045 . . . . 0.0 112.319 177.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -114.07 146.31 40.4 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 121.3 -0.875 . . . . 0.0 111.653 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -148.62 120.69 8.27 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.311 1.844 . . . . 0.0 108.982 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.287 1.9 mp0 40.28 -105.33 0.05 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.106 1.762 . . . . 0.0 112.952 -175.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -97.17 -69.29 0.76 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 120.448 1.476 . . . . 0.0 111.12 163.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -134.81 132.03 6.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 124.107 0.861 . . . . 0.0 111.509 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 32.7 m170 44.13 -70.67 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 129.366 3.066 . . . . 0.0 118.455 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.38 -56.46 2.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.812 1.245 . . . . 0.0 110.5 -177.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -144.88 -70.44 0.28 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.075 1.75 . . . . 0.0 112.125 -173.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.93 -69.53 0.84 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.45 1.1 . . . . 0.0 110.61 -174.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.61 -74.65 0.14 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.169 0.987 . . . . 0.0 109.268 162.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -125.86 125.68 43.22 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.77 1.228 . . . . 0.0 112.605 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -163.33 55.76 0.18 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.428 2.291 . . . . 0.0 109.33 168.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -142.31 0.42 1.33 Allowed 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -174.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -138.11 176.29 8.83 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.689 1.595 . . . . 0.0 113.144 -161.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.14 3.42 64.99 Favored Glycine 0 CA--C 1.546 1.97 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 167.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -162.78 134.65 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 119.828 1.814 . . . . 0.0 111.359 171.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.2 p -150.65 161.83 41.84 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.387 1.075 . . . . 0.0 112.905 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -101.31 134.65 44.05 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.931 2.092 . . . . 0.0 108.713 156.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.658 0 C-N-CA 125.026 1.298 . . . . 0.0 113.809 -177.285 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.485 1.293 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? 56.29 -167.22 0.11 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.411 1.485 . . . . 0.0 111.62 -160.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.68 165.36 3.94 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.83 1.252 . . . . 0.0 112.718 171.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mm -48.38 118.86 7.16 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.152 0.981 . . . . 0.0 111.922 -173.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo . . . . . 0 C--N 1.355 0.886 0 C-N-CA 121.535 1.49 . . . . 0.0 110.142 174.182 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.777 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.79 -0.35 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 130.967 3.707 . . . . 0.0 116.552 -173.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.1 tptm -128.13 6.12 5.91 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.498 1.919 . . . . 0.0 113.801 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.63 -40.4 0.2 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -172.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.84 158.59 51.42 Favored Glycine 0 N--CA 1.473 1.163 0 O-C-N 121.342 -0.849 . . . . 0.0 114.343 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -74.1 -9.78 22.27 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 124.189 3.259 . . . . 0.0 112.748 171.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.2 p -74.76 160.29 30.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.314 1.446 . . . . 0.0 111.752 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 52.0 mt 70.93 143.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.344 1.857 . . . . 0.0 114.136 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 89.11 156.29 31.46 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.665 1.602 . . . . 0.0 115.579 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -68.02 80.56 0.22 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 123.319 1.533 . . . . 0.0 111.488 171.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.8 tptt -86.02 4.94 35.71 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.163 1.385 . . . . 0.0 111.718 160.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 C-N-CA 123.434 0.694 . . . . 0.0 110.344 -155.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 39.4 mt . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.282 0.2 OUTLIER 57.64 177.17 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 126.04 1.736 . . . . 0.0 113.723 -169.374 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 68.0 117.76 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.953 2.101 . . . . 0.0 116.637 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.362 7.8 pt-20 38.56 -94.43 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 128.559 2.744 . . . . 0.0 115.667 -176.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.3 mt -152.93 -53.2 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.892 1.677 . . . . 0.0 109.376 167.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -161.72 -56.72 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.87 2.068 . . . . 0.0 108.346 -174.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -156.92 49.39 0.46 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 127.297 2.239 . . . . 0.0 110.93 172.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.4 t70 55.1 36.2 26.44 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 169.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -67.5 -47.88 68.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 119.296 -2.128 . . . . 0.0 114.375 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -99.58 -3.3 33.62 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -166.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.3 mt 53.95 -95.61 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.597 1.559 . . . . 0.0 112.814 -172.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -146.51 149.58 33.91 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.691 1.996 . . . . 0.0 111.676 -172.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.09 -9.87 0.02 OUTLIER Glycine 0 N--CA 1.478 1.461 0 N-CA-C 116.288 1.275 . . . . 0.0 116.288 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -133.15 5.36 3.82 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.472 2.309 . . . . 0.0 114.609 -163.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -79.09 0.43 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.056 1.342 . . . . 0.0 111.605 172.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 t -136.37 -55.34 0.75 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.869 -1.144 . . . . 0.0 113.639 -175.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . 0.291 6.3 t 60.35 -96.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 127.336 2.254 . . . . 0.0 113.663 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.409 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER -166.83 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.845 1.258 . . . . 0.0 111.211 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.409 ' H ' ' HB3' ' A' ' 87' ' ' PHE . . . . . . . . 0 CA--C 1.536 1.381 0 C-N-CA 125.618 1.58 . . . . 0.0 115.701 176.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.857 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 ptm -54.99 -29.22 56.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -165.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.01 -9.02 15.72 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.172 1.389 . . . . 0.0 112.349 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -105.5 -41.84 6.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 125.245 1.418 . . . . 0.0 111.728 -166.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.3 t -121.9 118.66 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.326 1.45 . . . . 0.0 109.55 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.8 t 61.13 -36.86 0.1 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 129.266 3.026 . . . . 0.0 117.726 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.73 125.04 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 1 C-N-CA 131.755 4.022 . . . . 0.0 116.664 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.9 mmt-85 -146.02 -125.74 0.07 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 127.921 2.488 . . . . 0.0 108.285 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -165.32 -174.73 3.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.621 2.768 . . . . 0.0 108.184 -174.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 55.72 -119.04 1.32 Allowed 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.23 -1.367 . . . . 0.0 111.949 -176.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 56.5 -166.63 4.32 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.47 1.986 . . . . 0.0 115.669 176.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -157.17 -39.52 0.07 Allowed 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 173.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.67 -84.57 0.47 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.745 1.618 . . . . 0.0 113.574 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -112.87 -112.19 0.34 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.882 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.61 -60.07 3.81 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.882 1.674 . . . . 0.0 112.379 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -170.33 -55.55 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 128.604 2.762 . . . . 0.0 109.442 172.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -159.23 106.19 1.75 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.425 1.89 . . . . 0.0 109.803 -152.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.78 -13.03 0.11 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -168.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.7 p -104.65 38.1 1.98 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -170.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -152.34 178.92 9.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.73 1.212 . . . . 0.0 112.134 -172.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.79 6.37 67.56 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 116.681 1.433 . . . . 0.0 116.681 167.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.252 20.0 m -106.52 -59.0 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.566 1.683 . . . . 0.0 114.544 -170.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.74 139.83 18.35 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.646 1.566 . . . . 0.0 111.626 -178.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -106.35 154.9 20.12 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.698 1.199 . . . . 0.0 113.683 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.461 0 C-N-CA 124.743 1.163 . . . . 0.0 112.854 -169.1 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.163 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -156.22 178.2 10.56 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 128.253 2.621 . . . . 0.0 109.649 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.15 82.98 0.13 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 40.6 mm -115.94 72.58 4.43 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 126.535 1.934 . . . . 0.0 108.108 174.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo . . . . . 0 C--O 1.244 0.796 0 C-N-CA 122.77 2.313 . . . . 0.0 113.207 -169.727 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.697 0 CA-C-O 121.133 0.492 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -84.47 -11.89 55.32 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.359 1.464 . . . . 0.0 113.812 -178.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -122.46 162.76 21.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.587 2.355 . . . . 0.0 110.79 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 70.67 -37.64 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 169.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -86.74 -55.11 2.49 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.356 1.455 . . . . 0.0 114.563 172.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -79.23 -166.39 0.41 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.753 2.969 . . . . 0.0 112.1 176.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -63.26 152.33 38.01 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.073 -1.017 . . . . 0.0 111.369 158.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . 0.311 0.1 OUTLIER 73.73 152.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 129.532 3.133 . . . . 0.0 115.518 -171.356 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.82 5.02 73.33 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 118.619 2.207 . . . . 0.0 118.619 163.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -81.57 -104.71 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.883 2.341 . . . . 0.0 111.623 168.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -81.02 -5.5 57.68 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 -157.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.425 HG13 ' H ' ' A' ' 63' ' ' ILE . 6.9 mt . . . . . 0 N--CA 1.487 1.396 0 C-N-CA 129.094 2.958 . . . . 0.0 114.57 -170.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.6 mt . . . . . 0 N--CA 1.47 0.561 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 tt -158.93 167.35 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.437 1.495 . . . . 0.0 110.689 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 75.78 117.87 0.06 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 128.847 2.859 . . . . 0.0 113.853 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.293 4.1 pt-20 40.53 -146.47 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.61 2.764 . . . . 0.0 116.149 174.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 39.5 mm -120.37 -70.49 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -129.99 -34.97 1.65 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.565 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt 179.68 83.07 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 126.752 2.021 . . . . 0.0 109.09 170.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -149.47 145.27 26.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -160.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -65.92 -9.84 33.26 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 165.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 65.68 5.75 3.5 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tt 65.81 115.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.538 2.335 . . . . 0.0 113.643 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.2 t80 67.5 130.77 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.439 1.896 . . . . 0.0 113.575 -175.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 131.9 -125.26 4.25 Favored Glycine 0 N--CA 1.473 1.142 0 O-C-N 121.083 -1.011 . . . . 0.0 110.805 -165.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -59.83 62.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 128.788 2.835 . . . . 0.0 112.185 169.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -167.09 -39.95 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.845 2.058 . . . . 0.0 110.585 -162.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.8 t -164.3 -46.62 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 173.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 t 45.1 -105.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 126.463 1.905 . . . . 0.0 113.952 -170.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -166.29 154.5 10.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.244 2.218 . . . . 0.0 109.35 -173.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.318 0 N-CA-C 115.006 0.763 . . . . 0.0 115.006 175.825 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.437 ' HA ' ' H ' ' A' ' 16' ' ' VAL . . . . . . . . 0 CA--C 1.538 0.511 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ptp -58.1 86.02 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 127.238 2.215 . . . . 0.0 115.224 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 62.17 37.01 14.68 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 112.14 -167.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.1 mt -129.64 -76.56 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 125.375 1.47 . . . . 0.0 109.395 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.437 ' H ' ' HA ' ' A' ' 12' ' ' ALA . 0.3 OUTLIER -100.32 -32.39 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.03 0.932 . . . . 0.0 112.746 -179.715 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.6 t -167.95 111.41 0.63 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.869 1.268 . . . . 0.0 109.581 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . 0.313 1.7 ppt_? -81.38 133.08 35.37 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 119.839 1.199 . . . . 0.0 113.574 176.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ttt-85 -149.72 -161.82 1.43 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 128.051 2.541 . . . . 0.0 107.73 171.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 66.88 156.93 0.11 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 167.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.97 -158.17 0.33 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.351 1.06 . . . . 0.0 110.994 -165.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.28 19.73 59.99 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 119.954 1.252 . . . . 0.0 115.113 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 26.8 m170 61.27 -43.8 0.13 Allowed 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 128.817 2.847 . . . . 0.0 115.35 -171.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 -67.66 0.88 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.977 1.711 . . . . 0.0 113.236 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -140.0 -90.89 0.17 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.523 1.129 . . . . 0.0 113.074 -175.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -87.46 -57.19 3.04 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.421 1.009 . . . . 0.0 110.511 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -171.6 -67.18 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 128.438 2.695 . . . . 0.0 106.586 161.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -105.73 165.93 10.82 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.717 2.007 . . . . 0.0 111.86 -175.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.28 9.12 5.39 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 118.808 2.892 . . . . 0.0 118.808 166.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.5 m -111.72 44.8 1.31 Allowed 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 119.771 1.169 . . . . 0.0 113.587 175.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.82 162.52 34.76 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.721 -1.237 . . . . 0.0 113.942 170.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.38 8.76 70.64 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 126.089 1.804 . . . . 0.0 114.563 -176.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -155.81 152.87 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 126.256 1.823 . . . . 0.0 110.128 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.1 151.78 28.71 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.518 2.327 . . . . 0.0 109.172 165.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.39 166.29 13.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.883 0.873 . . . . 0.0 110.434 162.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.637 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 177.38 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.95 167.64 9.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.109 1.364 . . . . 0.0 111.889 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 166.35 2.43 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.8 1.24 . . . . 0.0 113.306 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.9 mt -110.43 79.81 1.8 Allowed Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 124.455 1.102 . . . . 0.0 110.044 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 CA--C 1.539 0.731 0 C-N-CA 123.083 2.522 . . . . 0.0 110.526 164.53 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 115.428 1.64 . . . . 0.0 115.428 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.01 33.2 0.08 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 115.69 1.737 . . . . 0.0 115.69 -166.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -158.34 138.85 12.68 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.256 1.822 . . . . 0.0 108.432 170.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 67.32 -35.83 0.27 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -80.36 123.78 6.21 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-N 120.305 1.411 . . . . 0.0 112.307 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -81.12 -41.07 0.15 Allowed 'Trans proline' 0 C--N 1.362 1.242 0 C-N-CA 122.481 2.121 . . . . 0.0 111.787 177.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.2 p -69.61 172.95 6.6 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.701 1.6 . . . . 0.0 110.527 167.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 68.6 mt 67.41 -67.64 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.539 1.535 . . . . 0.0 110.22 -165.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 164.14 100.4 0.15 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 123.63 0.633 . . . . 0.0 114.065 170.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.77 -49.44 25.41 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.92 0.488 . . . . 0.0 111.405 173.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -146.0 95.44 2.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.01 0.924 . . . . 0.0 112.167 170.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.1 pp . . . . . 0 N--CA 1.476 0.843 0 C-N-CA 126.159 1.784 . . . . 0.0 110.344 -179.217 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.447 HG12 ' H ' ' A' ' 72' ' ' ALA 0.318 5.4 tt 49.12 -153.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 127.542 2.337 . . . . 0.0 113.044 176.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.447 ' H ' HG12 ' A' ' 71' ' ' ILE . . . 41.12 103.88 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 128.948 2.899 . . . . 0.0 117.013 173.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -68.9 175.4 3.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.545 -1.347 . . . . 0.0 113.043 168.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 10.5 mm -50.39 -53.41 12.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.653 1.181 . . . . 0.0 112.715 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -150.36 -60.66 0.19 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.178 1.791 . . . . 0.0 111.515 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -161.44 48.67 0.21 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 125.646 1.578 . . . . 0.0 112.591 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . 0.32 0.0 OUTLIER 63.79 -42.39 0.24 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.143 2.177 . . . . 0.0 116.075 -174.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -66.94 28.32 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 55.73 -25.69 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 130.879 3.671 . . . . 0.0 118.836 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.1 tt -142.65 -53.12 0.4 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.785 1.634 . . . . 0.0 111.271 -174.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -163.22 -40.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 167.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -168.83 -40.78 0.03 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.08 0.848 . . . . 0.0 113.87 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.35 166.02 30.26 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.468 2.307 . . . . 0.0 109.356 171.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.12 -35.21 7.69 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.7 t -146.99 -73.46 0.21 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.6 t 66.79 152.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 127.166 2.186 . . . . 0.0 113.889 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.259 0.2 OUTLIER 63.0 -142.41 0.37 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.534 1.534 . . . . 0.0 113.057 177.541 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.214 0 O-C-N 120.21 -1.556 . . . . 0.0 114.842 177.58 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.919 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 51.3 mtm -83.63 3.61 32.05 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.923 -1.111 . . . . 0.0 113.551 165.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -148.35 8.48 0.81 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 116.017 1.858 . . . . 0.0 116.017 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.3 mm -59.96 -42.26 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.733 -1.229 . . . . 0.0 113.671 -172.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.74 -71.36 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.869 0.867 . . . . 0.0 110.692 169.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -154.51 85.17 1.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.552 1.069 . . . . 0.0 111.979 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.2 mmt-85 -136.99 146.11 44.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.276 1.83 . . . . 0.0 110.222 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.64 -96.87 0.06 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 127.019 2.127 . . . . 0.0 106.405 149.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -132.51 -62.71 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.096 1.359 . . . . 0.0 111.55 161.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -154.79 173.35 16.58 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.086 2.154 . . . . 0.0 111.228 -177.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.1 -171.13 7.95 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.303 -0.873 . . . . 0.0 112.959 -169.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -143.65 -28.81 0.52 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.67 -99.19 0.45 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.872 1.269 . . . . 0.0 111.229 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -111.29 -104.56 0.38 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.434 1.494 . . . . 0.0 111.599 -167.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -73.12 -54.3 8.84 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.625 1.102 . . . . 0.0 110.956 177.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.08 -56.44 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.337 1.855 . . . . 0.0 110.497 157.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -131.69 108.84 9.76 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.417 1.487 . . . . 0.0 111.575 -164.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -165.37 47.36 0.09 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.088 0.955 . . . . 0.0 112.868 -175.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.1 p -155.13 6.65 0.25 Allowed 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 116.825 2.158 . . . . 0.0 116.825 -171.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.29 -170.8 3.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.255 1.422 . . . . 0.0 110.799 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.86 7.21 88.44 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 115.966 1.146 . . . . 0.0 115.966 170.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.26 19.7 m 48.76 83.09 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 127.952 2.501 . . . . 0.0 113.54 -177.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -57.4 147.29 26.58 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.051 1.34 . . . . 0.0 114.12 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 129.87 55.15 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.367 1.467 . . . . 0.0 109.823 -175.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.494 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -171.812 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 122.174 0.988 . . . . 0.0 111.773 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -170.06 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.254 1.822 . . . . 0.0 112.86 -176.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.26 156.77 0.15 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.563 1.145 . . . . 0.0 113.114 174.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.8 mp -102.04 86.54 0.88 Allowed Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 167.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 CA--C 1.539 0.754 0 C-N-CA 123.275 2.65 . . . . 0.0 110.984 177.073 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 CA-C-O 119.273 -0.394 . . . . 0.0 110.413 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 61.78 -50.42 0.14 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.299 2.64 . . . . 0.0 117.044 173.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.3 138.88 58.68 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.759 2.423 . . . . 0.0 111.521 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 62.05 -49.59 0.16 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 128.275 2.63 . . . . 0.0 116.165 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -124.11 96.43 0.53 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.012 1.768 . . . . 0.0 110.404 170.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.17 55.54 4.07 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 124.331 3.354 . . . . 0.0 111.341 169.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.12 158.13 19.23 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.181 2.592 . . . . 0.0 110.892 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.8 mt 58.54 52.46 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 122.697 1.236 . . . . 0.0 110.567 -160.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.43 136.26 12.61 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 125.26 1.41 . . . . 0.0 111.813 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -97.42 -19.74 18.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.459 1.504 . . . . 0.0 113.236 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.23 53.02 0.96 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.15 1.38 . . . . 0.0 112.361 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.8 mm . . . . . 0 CA--C 1.541 0.634 0 C-N-CA 127.234 2.213 . . . . 0.0 108.768 -174.999 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 CA--C 1.549 0.934 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.278 1.5 tp 57.06 -163.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 125.949 1.7 . . . . 0.0 114.839 166.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 65.7 -125.1 0.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -124.23 159.38 30.29 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.197 2.199 . . . . 0.0 112.397 -168.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.2 mt -73.72 -40.89 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.247 -0.908 . . . . 0.0 112.092 -170.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -49.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.851 1.26 . . . . 0.0 110.136 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -164.81 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.517 1.527 . . . . 0.0 113.007 170.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.52 38.23 0.54 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.901 0.88 . . . . 0.0 113.084 -175.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -74.19 -67.64 0.6 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -172.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.88 -0.55 31.19 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.163 1.347 . . . . 0.0 114.071 -176.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.1 mt 56.35 -177.23 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.017 1.327 . . . . 0.0 111.9 -160.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 45.35 -149.79 0.08 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.609 1.964 . . . . 0.0 114.845 177.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 73.04 34.51 58.51 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.2 -0.937 . . . . 0.0 113.385 -175.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -138.51 141.02 39.38 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.976 1.71 . . . . 0.0 110.804 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -78.2 -36.23 47.55 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -169.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -156.37 -53.12 0.08 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 -170.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 56.83 1.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 127.491 2.316 . . . . 0.0 115.714 -177.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.07 150.96 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.141 2.177 . . . . 0.0 114.477 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.387 0 N-CA-C 115.577 0.991 . . . . 0.0 115.577 179.127 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.384 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 52.0 mtm -69.62 114.81 8.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.469 1.031 . . . . 0.0 109.265 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 49.85 32.01 5.07 Favored 'General case' 0 CA--C 1.557 1.243 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -167.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.2 mt -127.4 -89.05 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.543 1.137 . . . . 0.0 109.253 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 88.3 t -103.09 -79.23 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.726 1.148 . . . . 0.0 111.297 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.5 t -81.74 80.55 8.03 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.61 1.095 . . . . 0.0 112.153 -171.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 45.4 mtt-85 -74.76 99.95 3.88 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 127.107 2.163 . . . . 0.0 111.378 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.63 130.04 12.12 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.539 1.535 . . . . 0.0 112.079 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 58.24 152.66 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.855 2.462 . . . . 0.0 116.116 -173.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 58.13 -161.12 0.24 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.838 0.855 . . . . 0.0 112.852 -167.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.57 -166.06 35.51 Favored Glycine 0 C--N 1.344 0.974 0 O-C-N 121.36 -0.838 . . . . 0.0 114.321 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -153.03 -72.99 0.14 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.84 -0.8 . . . . 0.0 112.77 173.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -69.12 0.86 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.578 1.151 . . . . 0.0 112.681 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -141.39 119.12 11.73 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.628 1.571 . . . . 0.0 109.521 -177.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 64.76 -61.75 0.2 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.734 2.414 . . . . 0.0 115.209 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -166.9 -57.04 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.49 2.716 . . . . 0.0 108.434 162.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.72 171.82 13.56 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.925 1.69 . . . . 0.0 112.43 -173.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.33 44.23 0.47 Allowed 'General case' 0 C--O 1.244 0.803 0 C-N-CA 123.948 0.899 . . . . 0.0 111.499 166.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.1 p -142.09 7.77 1.82 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 117.302 2.334 . . . . 0.0 117.302 -163.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -144.2 -143.7 0.15 Allowed 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 120.335 1.425 . . . . 0.0 112.093 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.18 -147.49 31.76 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 119.807 1.185 . . . . 0.0 115.019 172.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 23.7 t 66.84 -27.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 128.588 2.755 . . . . 0.0 115.941 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.39 -176.08 0.15 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.295 1.438 . . . . 0.0 113.932 171.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 t -137.95 128.64 26.76 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.271 1.828 . . . . 0.0 107.139 157.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.171 0 CA-C-O 118.828 -0.985 . . . . 0.0 114.989 -172.016 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.538 0.494 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.84 151.47 23.06 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . 58.77 30.47 20.06 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.6 mt -137.85 99.22 9.33 Favored Pre-proline 0 CA--C 1.554 1.123 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo . . . . . 0 CA--C 1.539 0.773 0 C-N-CA 124.298 3.332 . . . . 0.0 112.424 -179.109 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.849 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -56.51 -22.5 33.23 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.393 1.877 . . . . 0.0 114.49 -173.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -116.3 -51.37 2.62 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.48 1.912 . . . . 0.0 111.351 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -160.15 -31.54 0.06 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 176.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.2 -144.93 7.56 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 124.071 0.843 . . . . 0.0 112.298 -169.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.3 -177.55 3.53 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.765 2.977 . . . . 0.0 111.436 171.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 m -154.48 -22.42 0.13 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.968 -1.082 . . . . 0.0 113.651 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -148.56 16.96 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 124.333 1.053 . . . . 0.0 111.61 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.7 -153.86 46.31 Favored Glycine 0 CA--C 1.543 1.784 0 O-C-N 119.862 -1.774 . . . . 0.0 112.267 -154.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -91.3 70.77 6.12 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.08 0.952 . . . . 0.0 112.933 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -154.8 71.06 0.79 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.589 1.555 . . . . 0.0 110.049 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 53.0 mt . . . . . 0 N--CA 1.483 1.211 0 C-N-CA 126.508 1.923 . . . . 0.0 109.144 -173.918 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.288 1.1 mp 68.79 148.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.245 2.218 . . . . 0.0 114.047 -176.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 59.67 114.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.049 2.54 . . . . 0.0 115.277 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.316 17.1 pt-20 39.08 -133.72 0.15 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.21 1.804 . . . . 0.0 115.751 -177.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.1 pt -147.45 -68.51 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 125.94 1.696 . . . . 0.0 112.256 -168.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -159.37 -66.13 0.08 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.668 1.187 . . . . 0.0 110.684 -175.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.01 -74.11 0.33 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.633 1.173 . . . . 0.0 111.601 169.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -139.97 160.1 40.68 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.022 1.729 . . . . 0.0 108.423 164.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -161.03 -36.74 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 54.34 15.13 0.9 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.31 -70.25 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 126.484 1.914 . . . . 0.0 111.549 -161.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -147.8 143.19 27.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.27 1.828 . . . . 0.0 109.208 165.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 152.78 -10.36 0.58 Allowed Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.132 0.872 . . . . 0.0 114.761 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -123.15 92.81 3.78 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.965 1.706 . . . . 0.0 110.489 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -165.98 -74.27 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.098 1.759 . . . . 0.0 110.09 165.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.53 -45.73 0.09 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 t -139.38 -122.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 124.824 1.25 . . . . 0.0 109.367 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.1 146.13 13.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.922 1.289 . . . . 0.0 109.365 175.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.465 0 C-N-CA 123.756 0.693 . . . . 0.0 114.356 179.72 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.47 0.535 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -132.68 -44.99 0.88 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.068 1.347 . . . . 0.0 113.67 -172.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -137.92 -73.07 0.41 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.821 1.248 . . . . 0.0 112.758 -172.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.08 118.73 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 129.047 2.939 . . . . 0.0 117.182 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -73.8 -52.47 12.98 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 120.198 -1.564 . . . . 0.0 113.163 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 75.1 m -96.99 12.95 30.63 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 -166.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.295 0.0 OUTLIER 41.8 34.36 0.41 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 128.041 2.536 . . . . 0.0 116.694 175.306 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -163.25 -31.2 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 127.461 2.305 . . . . 0.0 112.319 176.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.91 -39.69 40.8 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 126.141 1.776 . . . . 0.0 114.815 -171.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -72.65 15.91 0.17 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.658 1.583 . . . . 0.0 114.584 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -144.09 -11.49 0.65 Allowed 'General case' 0 CA--C 1.538 0.517 0 O-C-N 120.431 -1.418 . . . . 0.0 113.586 178.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -54.05 -39.44 41.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 125.14 1.376 . . . . 0.0 112.62 -173.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.8 p -146.23 -61.76 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-O 118.551 -0.738 . . . . 0.0 112.314 169.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 5.6 t -162.46 56.8 0.22 Allowed 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.498 1.045 . . . . 0.0 112.319 177.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -114.07 146.31 40.4 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 121.3 -0.875 . . . . 0.0 111.653 176.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -148.62 120.69 8.27 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.311 1.844 . . . . 0.0 108.982 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.287 1.9 mp0 40.28 -105.33 0.05 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.106 1.762 . . . . 0.0 112.952 -175.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -97.17 -69.29 0.76 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 120.448 1.476 . . . . 0.0 111.12 163.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -134.81 132.03 6.12 Favored Glycine 0 N--CA 1.473 1.127 0 C-N-CA 124.107 0.861 . . . . 0.0 111.509 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 32.7 m170 44.13 -70.67 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 129.366 3.066 . . . . 0.0 118.455 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.38 -56.46 2.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.812 1.245 . . . . 0.0 110.5 -177.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -144.88 -70.44 0.28 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.075 1.75 . . . . 0.0 112.125 -173.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.93 -69.53 0.84 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.45 1.1 . . . . 0.0 110.61 -174.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.61 -74.65 0.14 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.169 0.987 . . . . 0.0 109.268 162.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -125.86 125.68 43.22 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.77 1.228 . . . . 0.0 112.605 -178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -163.33 55.76 0.18 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 127.428 2.291 . . . . 0.0 109.33 168.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -142.31 0.42 1.33 Allowed 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -174.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -138.11 176.29 8.83 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.689 1.595 . . . . 0.0 113.144 -161.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.14 3.42 64.99 Favored Glycine 0 CA--C 1.546 1.97 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 167.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.3 p -162.78 134.65 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 119.828 1.814 . . . . 0.0 111.359 171.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.2 p -150.65 161.83 41.84 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.387 1.075 . . . . 0.0 112.905 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.1 m -101.31 134.65 44.05 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.931 2.092 . . . . 0.0 108.713 156.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 170.34 169.01 32.96 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.026 1.298 . . . . 0.0 113.809 -177.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -139.31 85.94 14.96 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 126.039 1.736 . . . . 0.0 111.752 177.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.83 -30.66 26.58 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.787 2.325 . . . . 0.0 114.333 -174.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -106.99 -18.35 13.93 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -175.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 76.8 m -113.18 74.03 1.86 Allowed Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 125.467 1.507 . . . . 0.0 112.293 -178.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.62 37.66 0.37 Allowed 'Trans proline' 0 CA--C 1.556 1.576 0 C-N-CA 124.646 3.564 . . . . 0.0 114.701 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -160.03 20.86 0.16 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.038 1.735 . . . . 0.0 113.057 -172.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.1 m -66.69 -32.47 73.79 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 119.917 -1.74 . . . . 0.0 114.184 -171.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? 56.29 -167.22 0.11 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.411 1.485 . . . . 0.0 111.62 -160.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.68 165.36 3.94 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.83 1.252 . . . . 0.0 112.718 171.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 45.4 mm -48.38 118.86 7.16 Favored Pre-proline 0 N--CA 1.479 0.981 0 C-N-CA 124.152 0.981 . . . . 0.0 111.922 -173.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -68.92 140.43 45.88 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.535 1.49 . . . . 0.0 110.142 174.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -122.59 75.02 1.23 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.315 1.846 . . . . 0.0 106.662 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -71.09 -18.32 62.54 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 -158.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -100.39 6.22 44.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.542 1.937 . . . . 0.0 111.95 172.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -152.39 50.21 0.77 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.696 1.998 . . . . 0.0 110.605 -176.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.57 5.29 11.25 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.639 1.576 . . . . 0.0 113.676 177.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.79 -0.35 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 130.967 3.707 . . . . 0.0 116.552 -173.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.1 tptm -128.13 6.12 5.91 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.498 1.919 . . . . 0.0 113.801 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.63 -40.4 0.2 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -172.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.84 158.59 51.42 Favored Glycine 0 N--CA 1.473 1.163 0 O-C-N 121.342 -0.849 . . . . 0.0 114.343 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -74.1 -9.78 22.27 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 124.189 3.259 . . . . 0.0 112.748 171.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.2 p -74.76 160.29 30.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.314 1.446 . . . . 0.0 111.752 171.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 52.0 mt 70.93 143.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 126.344 1.857 . . . . 0.0 114.136 178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 89.11 156.29 31.46 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.665 1.602 . . . . 0.0 115.579 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -68.02 80.56 0.22 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 123.319 1.533 . . . . 0.0 111.488 171.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.8 tptt -86.02 4.94 35.71 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.163 1.385 . . . . 0.0 111.718 160.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -82.64 -74.72 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 123.434 0.694 . . . . 0.0 110.344 -155.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -121.88 -20.38 6.4 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -171.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.0 -0.48 14.75 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.621 1.168 . . . . 0.0 111.784 -177.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -78.38 -176.26 46.65 Favored Glycine 0 CA--C 1.541 1.666 0 C-N-CA 125.173 1.368 . . . . 0.0 114.353 173.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -122.3 53.46 1.23 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.871 1.269 . . . . 0.0 111.263 -167.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.92 -18.0 0.22 Allowed 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 116.955 2.206 . . . . 0.0 116.955 -175.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 54.54 85.08 0.06 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.015 1.726 . . . . 0.0 115.544 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 39.4 mt -133.29 -48.13 0.84 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.987 1.715 . . . . 0.0 112.523 170.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.282 0.2 OUTLIER 57.64 177.17 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 126.04 1.736 . . . . 0.0 113.723 -169.374 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 68.0 117.76 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.953 2.101 . . . . 0.0 116.637 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.362 7.8 pt-20 38.56 -94.43 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 128.559 2.744 . . . . 0.0 115.667 -176.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.3 mt -152.93 -53.2 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.892 1.677 . . . . 0.0 109.376 167.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -161.72 -56.72 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.87 2.068 . . . . 0.0 108.346 -174.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -156.92 49.39 0.46 Allowed 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 127.297 2.239 . . . . 0.0 110.93 172.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 28.4 t70 55.1 36.2 26.44 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 116.808 2.151 . . . . 0.0 116.808 169.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -67.5 -47.88 68.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 119.296 -2.128 . . . . 0.0 114.375 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -99.58 -3.3 33.62 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -166.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.3 mt 53.95 -95.61 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.597 1.559 . . . . 0.0 112.814 -172.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -146.51 149.58 33.91 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.691 1.996 . . . . 0.0 111.676 -172.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.09 -9.87 0.02 OUTLIER Glycine 0 N--CA 1.478 1.461 0 N-CA-C 116.288 1.275 . . . . 0.0 116.288 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -133.15 5.36 3.82 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.472 2.309 . . . . 0.0 114.609 -163.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -94.7 -79.09 0.43 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.056 1.342 . . . . 0.0 111.605 172.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 t -136.37 -55.34 0.75 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.869 -1.144 . . . . 0.0 113.639 -175.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . 0.291 6.3 t 60.35 -96.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 127.336 2.254 . . . . 0.0 113.663 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.409 ' HB3' ' H ' ' A' ' 88' ' ' GLY . 0.1 OUTLIER -166.83 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.845 1.258 . . . . 0.0 111.211 179.612 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.409 ' H ' ' HB3' ' A' ' 87' ' ' PHE . . . -72.22 -168.61 11.2 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 125.618 1.58 . . . . 0.0 115.701 176.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 167.12 -153.1 22.44 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 124.706 1.146 . . . . 0.0 112.327 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -74.38 62.84 2.23 Favored Glycine 0 N--CA 1.472 1.074 0 C-N-CA 125.22 1.39 . . . . 0.0 114.927 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -145.57 110.84 5.3 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.295 1.038 . . . . 0.0 110.65 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -137.05 -155.49 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 126.324 1.85 . . . . 0.0 111.043 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.9 tp . . . . . 0 N--CA 1.485 1.282 0 C-N-CA 127.379 2.272 . . . . 0.0 113.806 -167.65 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.7 p . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 119.802 -0.142 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 53.2 t30 60.32 -67.52 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 129.234 3.013 . . . . 0.0 114.453 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -131.56 -45.79 0.98 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.396 1.479 . . . . 0.0 111.544 177.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 64.33 127.18 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 128.601 2.76 . . . . 0.0 116.52 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -134.31 -89.97 0.36 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.782 2.033 . . . . 0.0 108.849 174.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.5 m -77.4 63.69 2.62 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.183 1.793 . . . . 0.0 111.414 -175.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 23.94 75.87 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 128.599 2.759 . . . . 0.0 113.723 169.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 58.4 1.64 0.18 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.33 -38.17 35.81 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 121.392 1.905 . . . . 0.0 111.826 168.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 19.3 ptm -54.99 -29.22 56.74 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -165.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -108.01 -9.02 15.72 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.172 1.389 . . . . 0.0 112.349 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -105.5 -41.84 6.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 C-N-CA 125.245 1.418 . . . . 0.0 111.728 -166.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 45.3 t -121.9 118.66 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.326 1.45 . . . . 0.0 109.55 -175.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.8 t 61.13 -36.86 0.1 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 129.266 3.026 . . . . 0.0 117.726 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.73 125.04 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 1 C-N-CA 131.755 4.022 . . . . 0.0 116.664 177.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.9 mmt-85 -146.02 -125.74 0.07 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 127.921 2.488 . . . . 0.0 108.285 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -165.32 -174.73 3.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 128.621 2.768 . . . . 0.0 108.184 -174.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 55.72 -119.04 1.32 Allowed 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 117.23 -1.367 . . . . 0.0 111.949 -176.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 56.5 -166.63 4.32 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.47 1.986 . . . . 0.0 115.669 176.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -157.17 -39.52 0.07 Allowed 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 173.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.67 -84.57 0.47 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.745 1.618 . . . . 0.0 113.574 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -112.87 -112.19 0.34 Allowed 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.882 -177.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.61 -60.07 3.81 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-N 120.882 1.674 . . . . 0.0 112.379 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -170.33 -55.55 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 128.604 2.762 . . . . 0.0 109.442 172.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -159.23 106.19 1.75 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.425 1.89 . . . . 0.0 109.803 -152.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.78 -13.03 0.11 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 115.788 1.773 . . . . 0.0 115.788 -168.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.7 p -104.65 38.1 1.98 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -170.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -152.34 178.92 9.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.73 1.212 . . . . 0.0 112.134 -172.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.79 6.37 67.56 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 116.681 1.433 . . . . 0.0 116.681 167.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.252 20.0 m -106.52 -59.0 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 119.566 1.683 . . . . 0.0 114.544 -170.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.74 139.83 18.35 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.646 1.566 . . . . 0.0 111.626 -178.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -106.35 154.9 20.12 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.698 1.199 . . . . 0.0 113.683 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 90.72 -173.31 38.24 Favored Glycine 0 N--CA 1.478 1.461 0 C-N-CA 124.743 1.163 . . . . 0.0 112.854 -169.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -76.92 128.85 80.42 Favored Pre-proline 0 CA--C 1.549 0.915 0 O-C-N 121.61 -0.935 . . . . 0.0 112.527 -163.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -96.17 -51.14 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 123.673 2.915 . . . . 0.0 113.845 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -108.69 33.23 4.32 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 126.038 1.735 . . . . 0.0 110.304 -177.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -147.75 153.93 43.42 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 125.82 1.648 . . . . 0.0 111.969 -175.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -77.54 3.26 6.98 Favored 'Trans proline' 0 C--O 1.238 0.477 0 C-N-CA 123.474 2.782 . . . . 0.0 115.663 -163.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.54 -32.02 53.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.676 1.191 . . . . 0.0 112.639 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 53.85 -147.57 0.49 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 126.331 1.853 . . . . 0.0 113.813 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -156.22 178.2 10.56 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 128.253 2.621 . . . . 0.0 109.649 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.15 82.98 0.13 Allowed 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -175.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 40.6 mm -115.94 72.58 4.43 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 126.535 1.934 . . . . 0.0 108.108 174.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -62.48 148.35 93.44 Favored 'Trans proline' 0 C--O 1.244 0.796 0 C-N-CA 122.77 2.313 . . . . 0.0 113.207 -169.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -74.26 65.6 1.2 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.062 1.745 . . . . 0.0 112.05 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -51.14 -35.86 37.9 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.636 1.574 . . . . 0.0 113.28 -176.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -95.97 -4.75 42.71 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.134 1.373 . . . . 0.0 113.439 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -147.51 25.05 1.09 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 -168.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.52 54.58 1.78 Allowed 'General case' 0 CA--C 1.543 0.697 0 O-C-N 120.217 -1.552 . . . . 0.0 110.41 172.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.0 p30 -84.47 -11.89 55.32 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.359 1.464 . . . . 0.0 113.812 -178.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -122.46 162.76 21.08 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.587 2.355 . . . . 0.0 110.79 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 70.67 -37.64 0.39 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 169.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -86.74 -55.11 2.49 Favored Glycine 0 CA--C 1.54 1.651 0 C-N-CA 125.356 1.455 . . . . 0.0 114.563 172.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -79.23 -166.39 0.41 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.753 2.969 . . . . 0.0 112.1 176.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -63.26 152.33 38.01 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 121.073 -1.017 . . . . 0.0 111.369 158.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . 0.311 0.1 OUTLIER 73.73 152.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 129.532 3.133 . . . . 0.0 115.518 -171.356 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.82 5.02 73.33 Favored Glycine 0 CA--C 1.534 1.279 0 N-CA-C 118.619 2.207 . . . . 0.0 118.619 163.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.1 t0 -81.57 -104.71 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.883 2.341 . . . . 0.0 111.623 168.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -81.02 -5.5 57.68 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 -157.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.425 HG13 ' H ' ' A' ' 63' ' ' ILE . 6.9 mt -32.23 -51.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 129.094 2.958 . . . . 0.0 114.57 -170.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.8 mpp_? -139.98 -25.51 0.8 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.21 1.404 . . . . 0.0 112.349 162.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -90.9 26.21 2.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.666 1.587 . . . . 0.0 112.207 -177.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -76.43 -162.12 13.14 Favored Glycine 0 CA--C 1.536 1.35 0 CA-C-O 121.992 0.773 . . . . 0.0 112.009 164.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -137.82 -35.54 0.64 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.923 1.289 . . . . 0.0 112.025 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.0 t -93.83 -25.08 17.51 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 174.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.84 166.81 11.29 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -162.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.6 mt -92.6 -92.04 0.16 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -167.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 tt -158.93 167.35 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 125.437 1.495 . . . . 0.0 110.689 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 75.78 117.87 0.06 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 128.847 2.859 . . . . 0.0 113.853 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.293 4.1 pt-20 40.53 -146.47 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.61 2.764 . . . . 0.0 116.149 174.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 39.5 mm -120.37 -70.49 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -129.99 -34.97 1.65 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 117.467 -1.254 . . . . 0.0 112.565 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt 179.68 83.07 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 126.752 2.021 . . . . 0.0 109.09 170.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -149.47 145.27 26.81 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -160.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -65.92 -9.84 33.26 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 165.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 65.68 5.75 3.5 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 tt 65.81 115.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.538 2.335 . . . . 0.0 113.643 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.2 t80 67.5 130.77 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.439 1.896 . . . . 0.0 113.575 -175.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 131.9 -125.26 4.25 Favored Glycine 0 N--CA 1.473 1.142 0 O-C-N 121.083 -1.011 . . . . 0.0 110.805 -165.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -59.83 62.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 128.788 2.835 . . . . 0.0 112.185 169.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -167.09 -39.95 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.845 2.058 . . . . 0.0 110.585 -162.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 22.8 t -164.3 -46.62 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 173.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 t 45.1 -105.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 C-N-CA 126.463 1.905 . . . . 0.0 113.952 -170.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -166.29 154.5 10.52 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.244 2.218 . . . . 0.0 109.35 -173.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -166.03 -171.0 31.68 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 115.006 0.763 . . . . 0.0 115.006 175.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -161.57 -160.06 10.58 Favored Glycine 0 CA--C 1.54 1.627 0 C-N-CA 125.901 1.715 . . . . 0.0 112.901 -176.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 119.06 71.04 0.35 Allowed Glycine 0 CA--C 1.538 1.481 0 C-N-CA 123.945 0.783 . . . . 0.0 113.175 174.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -138.4 135.84 35.68 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.389 1.476 . . . . 0.0 111.255 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 59.4 t -103.23 33.52 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 125.813 1.645 . . . . 0.0 112.252 -176.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.8 mp . . . . . 0 C--O 1.255 1.383 0 C-N-CA 127.12 2.168 . . . . 0.0 108.84 170.13 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.1 t . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.6 m120 58.86 -69.52 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 127.504 2.321 . . . . 0.0 115.726 173.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -134.4 -65.8 0.63 Allowed 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 127.852 2.461 . . . . 0.0 108.621 171.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 54.98 141.12 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 128.406 2.682 . . . . 0.0 116.596 -176.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -76.48 -95.14 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.646 1.178 . . . . 0.0 111.396 170.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 4.5 m -78.07 52.5 1.09 Allowed 'General case' 0 CA--C 1.542 0.659 0 O-C-N 120.699 -1.251 . . . . 0.0 114.249 -170.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 17.41 77.05 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 128.668 2.787 . . . . 0.0 116.903 166.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 54.19 24.59 5.04 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.437 ' HA ' ' H ' ' A' ' 16' ' ' VAL . . . -111.19 -27.48 8.68 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.869 2.068 . . . . 0.0 113.735 175.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 ptp -58.1 86.02 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 127.238 2.215 . . . . 0.0 115.224 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 62.17 37.01 14.68 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 112.14 -167.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.1 mt -129.64 -76.56 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 125.375 1.47 . . . . 0.0 109.395 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.437 ' H ' ' HA ' ' A' ' 12' ' ' ALA . 0.3 OUTLIER -100.32 -32.39 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 124.03 0.932 . . . . 0.0 112.746 -179.715 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 16.6 t -167.95 111.41 0.63 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.869 1.268 . . . . 0.0 109.581 176.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . 0.313 1.7 ppt_? -81.38 133.08 35.37 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 119.839 1.199 . . . . 0.0 113.574 176.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ttt-85 -149.72 -161.82 1.43 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 128.051 2.541 . . . . 0.0 107.73 171.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 66.88 156.93 0.11 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 167.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.97 -158.17 0.33 Allowed 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.351 1.06 . . . . 0.0 110.994 -165.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.28 19.73 59.99 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 119.954 1.252 . . . . 0.0 115.113 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 26.8 m170 61.27 -43.8 0.13 Allowed 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 128.817 2.847 . . . . 0.0 115.35 -171.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 -67.66 0.88 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.977 1.711 . . . . 0.0 113.236 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -140.0 -90.89 0.17 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.523 1.129 . . . . 0.0 113.074 -175.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -87.46 -57.19 3.04 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.421 1.009 . . . . 0.0 110.511 -177.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -171.6 -67.18 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 128.438 2.695 . . . . 0.0 106.586 161.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -105.73 165.93 10.82 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.717 2.007 . . . . 0.0 111.86 -175.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.28 9.12 5.39 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 118.808 2.892 . . . . 0.0 118.808 166.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.5 m -111.72 44.8 1.31 Allowed 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 119.771 1.169 . . . . 0.0 113.587 175.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.82 162.52 34.76 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.721 -1.237 . . . . 0.0 113.942 170.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 88.38 8.76 70.64 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 126.089 1.804 . . . . 0.0 114.563 -176.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.1 p -155.81 152.87 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 126.256 1.823 . . . . 0.0 110.128 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.1 151.78 28.71 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 127.518 2.327 . . . . 0.0 109.172 165.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -119.39 166.29 13.25 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.883 0.873 . . . . 0.0 110.434 162.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 153.73 105.1 0.25 Allowed Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 177.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -115.62 75.24 4.96 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -167.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -63.11 -30.1 75.08 Favored 'Trans proline' 0 C--N 1.36 1.16 0 C-N-CA 123.883 3.056 . . . . 0.0 113.628 -177.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -103.39 -3.79 25.0 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.163 1.385 . . . . 0.0 113.018 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 75.1 m -135.0 59.18 32.44 Favored Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 124.619 1.168 . . . . 0.0 112.138 -178.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -65.61 -37.28 29.68 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.536 2.158 . . . . 0.0 113.937 -174.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.73 24.47 0.03 OUTLIER 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 167.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.1 p -81.45 159.39 24.27 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -167.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.95 167.64 9.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.109 1.364 . . . . 0.0 111.889 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 166.35 2.43 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.8 1.24 . . . . 0.0 113.306 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 39.9 mt -110.43 79.81 1.8 Allowed Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 124.455 1.102 . . . . 0.0 110.044 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -75.01 165.44 31.31 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.083 2.522 . . . . 0.0 110.526 164.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -87.02 102.35 14.32 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 175.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -84.46 2.21 41.95 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.564 1.145 . . . . 0.0 113.699 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -145.29 3.9 1.04 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.567 1.547 . . . . 0.0 112.828 -164.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -168.4 172.7 8.15 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 129.555 3.142 . . . . 0.0 107.203 -174.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -144.67 40.61 1.3 Allowed 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 121.526 1.966 . . . . 0.0 115.428 -170.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -74.01 33.2 0.08 Allowed 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 115.69 1.737 . . . . 0.0 115.69 -166.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -158.34 138.85 12.68 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.256 1.822 . . . . 0.0 108.432 170.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 67.32 -35.83 0.27 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 116.611 2.078 . . . . 0.0 116.611 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -80.36 123.78 6.21 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-N 120.305 1.411 . . . . 0.0 112.307 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -81.12 -41.07 0.15 Allowed 'Trans proline' 0 C--N 1.362 1.242 0 C-N-CA 122.481 2.121 . . . . 0.0 111.787 177.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.2 p -69.61 172.95 6.6 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.701 1.6 . . . . 0.0 110.527 167.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 68.6 mt 67.41 -67.64 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.539 1.535 . . . . 0.0 110.22 -165.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 164.14 100.4 0.15 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 123.63 0.633 . . . . 0.0 114.065 170.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.9 t0 -73.77 -49.44 25.41 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.92 0.488 . . . . 0.0 111.405 173.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -146.0 95.44 2.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.01 0.924 . . . . 0.0 112.167 170.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.1 pp -136.73 -124.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 126.159 1.784 . . . . 0.0 110.344 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 26.7 mtp180 -58.55 -38.53 78.0 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 126.159 1.784 . . . . 0.0 113.603 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.22 45.41 1.07 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.506 1.122 . . . . 0.0 110.112 175.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -97.43 -108.65 2.64 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 125.157 1.36 . . . . 0.0 111.167 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -160.49 -55.75 0.05 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.164 1.385 . . . . 0.0 109.488 174.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -155.38 39.7 0.4 Allowed 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 122.625 1.202 . . . . 0.0 112.303 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -93.0 -168.38 1.92 Allowed 'General case' 0 CA--C 1.555 1.148 0 O-C-N 120.599 -1.313 . . . . 0.0 111.862 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.61 27.01 0.54 Allowed 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -169.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.447 HG12 ' H ' ' A' ' 72' ' ' ALA 0.318 5.4 tt 49.12 -153.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 127.542 2.337 . . . . 0.0 113.044 176.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.447 ' H ' HG12 ' A' ' 71' ' ' ILE . . . 41.12 103.88 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 128.948 2.899 . . . . 0.0 117.013 173.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -68.9 175.4 3.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.545 -1.347 . . . . 0.0 113.043 168.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 10.5 mm -50.39 -53.41 12.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.653 1.181 . . . . 0.0 112.715 -172.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -150.36 -60.66 0.19 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.178 1.791 . . . . 0.0 111.515 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.6 ptpt -161.44 48.67 0.21 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 125.646 1.578 . . . . 0.0 112.591 -174.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . 0.32 0.0 OUTLIER 63.79 -42.39 0.24 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 127.143 2.177 . . . . 0.0 116.075 -174.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -66.94 28.32 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 116.105 1.891 . . . . 0.0 116.105 178.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 55.73 -25.69 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 130.879 3.671 . . . . 0.0 118.836 176.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.1 tt -142.65 -53.12 0.4 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.785 1.634 . . . . 0.0 111.271 -174.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -163.22 -40.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 167.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -168.83 -40.78 0.03 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.08 0.848 . . . . 0.0 113.87 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -149.35 166.02 30.26 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.468 2.307 . . . . 0.0 109.356 171.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.12 -35.21 7.69 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.7 t -146.99 -73.46 0.21 Allowed 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 170.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.6 t 66.79 152.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 127.166 2.186 . . . . 0.0 113.889 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.259 0.2 OUTLIER 63.0 -142.41 0.37 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.534 1.534 . . . . 0.0 113.057 177.541 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.93 -158.92 19.61 Favored Glycine 0 CA--C 1.533 1.214 0 O-C-N 120.21 -1.556 . . . . 0.0 114.842 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 153.89 -169.09 32.44 Favored Glycine 0 CA--C 1.543 1.833 0 C-N-CA 124.523 1.058 . . . . 0.0 113.883 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 167.23 103.72 0.17 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 123.833 0.73 . . . . 0.0 112.714 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -141.29 120.81 13.25 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.19 1.396 . . . . 0.0 110.59 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 1.7 t -123.61 23.97 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 125.76 1.624 . . . . 0.0 111.714 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mp . . . . . 0 C--O 1.244 0.787 0 C-N-CA 126.652 1.981 . . . . 0.0 108.788 173.117 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 39.4 t30 58.08 -60.91 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 128.328 2.651 . . . . 0.0 116.536 -173.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -141.61 149.11 40.28 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.764 1.165 . . . . 0.0 111.887 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 44.9 -144.43 0.16 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.063 1.345 . . . . 0.0 111.765 -166.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -162.82 -43.92 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.962 -1.086 . . . . 0.0 112.508 160.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 58.9 m -91.79 11.84 23.39 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.824 1.25 . . . . 0.0 112.655 -176.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.313 0.0 OUTLIER 49.49 -11.48 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 131.434 3.894 . . . . 0.0 120.867 173.327 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.35 -18.25 9.26 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.338 1.855 . . . . 0.0 112.823 166.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.98 0.07 0.99 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 -176.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 51.3 mtm -83.63 3.61 32.05 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.923 -1.111 . . . . 0.0 113.551 165.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -148.35 8.48 0.81 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 116.017 1.858 . . . . 0.0 116.017 171.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.3 mm -59.96 -42.26 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.733 -1.229 . . . . 0.0 113.671 -172.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.74 -71.36 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.869 0.867 . . . . 0.0 110.692 169.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -154.51 85.17 1.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.552 1.069 . . . . 0.0 111.979 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.2 mmt-85 -136.99 146.11 44.94 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.276 1.83 . . . . 0.0 110.222 -179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.64 -96.87 0.06 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 127.019 2.127 . . . . 0.0 106.405 149.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -132.51 -62.71 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.096 1.359 . . . . 0.0 111.55 161.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -154.79 173.35 16.58 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.086 2.154 . . . . 0.0 111.228 -177.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.1 -171.13 7.95 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.303 -0.873 . . . . 0.0 112.959 -169.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 31.3 m80 -143.65 -28.81 0.52 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.67 -99.19 0.45 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.872 1.269 . . . . 0.0 111.229 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -111.29 -104.56 0.38 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.434 1.494 . . . . 0.0 111.599 -167.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -73.12 -54.3 8.84 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.625 1.102 . . . . 0.0 110.956 177.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.08 -56.44 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.337 1.855 . . . . 0.0 110.497 157.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -131.69 108.84 9.76 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.417 1.487 . . . . 0.0 111.575 -164.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -165.37 47.36 0.09 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.088 0.955 . . . . 0.0 112.868 -175.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.1 p -155.13 6.65 0.25 Allowed 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 116.825 2.158 . . . . 0.0 116.825 -171.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.29 -170.8 3.06 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.255 1.422 . . . . 0.0 110.799 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.86 7.21 88.44 Favored Glycine 0 CA--C 1.535 1.323 0 N-CA-C 115.966 1.146 . . . . 0.0 115.966 170.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . 0.26 19.7 m 48.76 83.09 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 127.952 2.501 . . . . 0.0 113.54 -177.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -57.4 147.29 26.58 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.051 1.34 . . . . 0.0 114.12 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.0 m -108.15 129.87 55.15 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.367 1.467 . . . . 0.0 109.823 -175.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 178.46 71.29 0.06 OUTLIER Glycine 0 CA--C 1.522 0.494 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -171.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -130.64 51.9 8.44 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 126.051 1.74 . . . . 0.0 111.744 -167.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -62.52 -34.07 76.58 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 123.859 3.04 . . . . 0.0 114.086 -170.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -98.88 1.88 46.14 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.433 1.893 . . . . 0.0 112.537 173.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 73.2 m -125.71 38.72 0.42 Allowed Pre-proline 0 CA--C 1.554 1.124 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 -170.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -64.78 -21.25 64.85 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.94 2.427 . . . . 0.0 114.83 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -154.32 39.32 0.45 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.566 1.075 . . . . 0.0 113.205 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 6.2 m -63.43 145.01 56.47 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.086 -1.009 . . . . 0.0 111.773 -170.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -170.06 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.254 1.822 . . . . 0.0 112.86 -176.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -46.26 156.77 0.15 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.563 1.145 . . . . 0.0 113.114 174.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.8 mp -102.04 86.54 0.88 Allowed Pre-proline 0 CA--C 1.542 0.663 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 167.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -74.9 -171.94 1.11 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.275 2.65 . . . . 0.0 110.984 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -67.66 64.71 0.08 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.771 1.229 . . . . 0.0 111.168 167.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -48.54 -42.42 33.26 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 120.108 1.322 . . . . 0.0 113.601 -177.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -74.45 -20.35 60.05 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.668 1.187 . . . . 0.0 113.973 177.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 14.9 t80 -140.81 46.27 1.77 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.465 1.906 . . . . 0.0 110.673 -168.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.97 -120.92 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.873 1.269 . . . . 0.0 110.413 -174.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 61.78 -50.42 0.14 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.299 2.64 . . . . 0.0 117.044 173.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -63.3 138.88 58.68 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 127.759 2.423 . . . . 0.0 111.521 176.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 62.05 -49.59 0.16 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 128.275 2.63 . . . . 0.0 116.165 179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -124.11 96.43 0.53 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.012 1.768 . . . . 0.0 110.404 170.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -75.17 55.54 4.07 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 124.331 3.354 . . . . 0.0 111.341 169.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.12 158.13 19.23 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.181 2.592 . . . . 0.0 110.892 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.8 mt 58.54 52.46 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 CA-C-O 122.697 1.236 . . . . 0.0 110.567 -160.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.43 136.26 12.61 Favored Glycine 0 CA--C 1.53 0.969 0 C-N-CA 125.26 1.41 . . . . 0.0 111.813 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -97.42 -19.74 18.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.459 1.504 . . . . 0.0 113.236 -178.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.23 53.02 0.96 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.15 1.38 . . . . 0.0 112.361 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.8 mm -114.86 -100.05 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 127.234 2.213 . . . . 0.0 108.768 -174.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -95.13 -14.66 23.98 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 177.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.83 12.66 22.84 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.449 1.5 . . . . 0.0 111.558 165.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -72.56 -119.63 0.06 OUTLIER Glycine 0 CA--C 1.531 1.093 0 C-N-CA 125.497 1.523 . . . . 0.0 112.726 174.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -155.44 -58.3 0.1 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.175 0.99 . . . . 0.0 110.021 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.7 t -147.29 31.81 0.91 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 122.252 1.025 . . . . 0.0 112.637 170.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -77.1 -178.63 5.12 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.84 1.256 . . . . 0.0 111.604 175.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.4 mt -74.63 16.13 0.3 Allowed 'General case' 0 CA--C 1.549 0.934 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -167.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.278 1.5 tp 57.06 -163.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 125.949 1.7 . . . . 0.0 114.839 166.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 65.7 -125.1 0.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 173.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -124.23 159.38 30.29 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.197 2.199 . . . . 0.0 112.397 -168.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.2 mt -73.72 -40.89 54.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.247 -0.908 . . . . 0.0 112.092 -170.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -49.07 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.851 1.26 . . . . 0.0 110.136 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.1 ptpt -164.81 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.517 1.527 . . . . 0.0 113.007 170.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -152.52 38.23 0.54 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.901 0.88 . . . . 0.0 113.084 -175.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -74.19 -67.64 0.6 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -172.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.88 -0.55 31.19 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.163 1.347 . . . . 0.0 114.071 -176.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 46.1 mt 56.35 -177.23 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.017 1.327 . . . . 0.0 111.9 -160.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 45.35 -149.79 0.08 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.609 1.964 . . . . 0.0 114.845 177.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 73.04 34.51 58.51 Favored Glycine 0 CA--C 1.533 1.164 0 O-C-N 121.2 -0.937 . . . . 0.0 113.385 -175.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -138.51 141.02 39.38 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.976 1.71 . . . . 0.0 110.804 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -78.2 -36.23 47.55 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 -169.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -156.37 -53.12 0.08 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.855 1.058 . . . . 0.0 113.855 -170.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 56.83 1.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 127.491 2.316 . . . . 0.0 115.714 -177.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 63.07 150.96 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.141 2.177 . . . . 0.0 114.477 -168.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -164.52 -176.51 36.35 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 115.577 0.991 . . . . 0.0 115.577 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 173.77 174.26 40.57 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 127.076 2.274 . . . . 0.0 111.443 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 162.37 86.6 0.06 OUTLIER Glycine 0 CA--C 1.534 1.279 0 CA-C-N 117.708 0.754 . . . . 0.0 113.465 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -149.24 146.06 27.41 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.44 1.096 . . . . 0.0 112.61 -175.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -141.9 -153.35 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 126.395 1.878 . . . . 0.0 109.764 173.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 96.7 mt . . . . . 0 N--CA 1.484 1.252 0 C-N-CA 127.485 2.314 . . . . 0.0 111.31 -171.275 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.4 m-20 51.86 -111.44 0.57 Allowed 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 125.137 1.375 . . . . 0.0 110.932 -173.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -74.93 -54.29 7.48 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 119.977 1.262 . . . . 0.0 113.444 174.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.07 100.35 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.739 2.016 . . . . 0.0 115.021 -159.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -94.95 -30.25 14.24 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.258 1.423 . . . . 0.0 112.526 174.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 71.0 m -102.67 -0.4 31.84 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.539 1.936 . . . . 0.0 113.432 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . 0.26 0.0 OUTLIER 46.73 43.54 13.02 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.049 2.14 . . . . 0.0 115.134 171.232 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 60.65 71.83 0.55 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.775 2.43 . . . . 0.0 113.97 -176.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -134.15 -44.01 0.79 Allowed 'General case' 0 C--N 1.348 0.528 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 -171.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 52.0 mtm -69.62 114.81 8.19 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 119.469 1.031 . . . . 0.0 109.265 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 49.85 32.01 5.07 Favored 'General case' 0 CA--C 1.557 1.243 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -167.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.2 mt -127.4 -89.05 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.543 1.137 . . . . 0.0 109.253 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 88.3 t -103.09 -79.23 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-N 119.726 1.148 . . . . 0.0 111.297 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 13.5 t -81.74 80.55 8.03 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.61 1.095 . . . . 0.0 112.153 -171.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 45.4 mtt-85 -74.76 99.95 3.88 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 127.107 2.163 . . . . 0.0 111.378 -173.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.63 130.04 12.12 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.539 1.535 . . . . 0.0 112.079 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 58.24 152.66 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.855 2.462 . . . . 0.0 116.116 -173.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 58.13 -161.12 0.24 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 123.838 0.855 . . . . 0.0 112.852 -167.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.57 -166.06 35.51 Favored Glycine 0 C--N 1.344 0.974 0 O-C-N 121.36 -0.838 . . . . 0.0 114.321 -178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -153.03 -72.99 0.14 Allowed 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.84 -0.8 . . . . 0.0 112.77 173.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -69.12 0.86 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.578 1.151 . . . . 0.0 112.681 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -141.39 119.12 11.73 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.628 1.571 . . . . 0.0 109.521 -177.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 64.76 -61.75 0.2 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.734 2.414 . . . . 0.0 115.209 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -166.9 -57.04 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 128.49 2.716 . . . . 0.0 108.434 162.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.72 171.82 13.56 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.925 1.69 . . . . 0.0 112.43 -173.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -155.33 44.23 0.47 Allowed 'General case' 0 C--O 1.244 0.803 0 C-N-CA 123.948 0.899 . . . . 0.0 111.499 166.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 73.1 p -142.09 7.77 1.82 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 117.302 2.334 . . . . 0.0 117.302 -163.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -144.2 -143.7 0.15 Allowed 'General case' 0 CA--C 1.557 1.246 0 CA-C-N 120.335 1.425 . . . . 0.0 112.093 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.18 -147.49 31.76 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-N 119.807 1.185 . . . . 0.0 115.019 172.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 23.7 t 66.84 -27.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 C-N-CA 128.588 2.755 . . . . 0.0 115.941 -175.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.39 -176.08 0.15 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.295 1.438 . . . . 0.0 113.932 171.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 t -137.95 128.64 26.76 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.271 1.828 . . . . 0.0 107.139 157.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 176.44 55.08 0.06 OUTLIER Glycine 0 CA--C 1.533 1.171 0 CA-C-O 118.828 -0.985 . . . . 0.0 114.989 -172.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.17 111.73 26.83 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 124.764 1.226 . . . . 0.0 111.706 173.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -86.35 -31.11 0.32 Allowed 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.723 2.949 . . . . 0.0 114.577 174.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -119.39 -25.77 5.98 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.66 1.184 . . . . 0.0 113.132 -173.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 95.2 m -73.37 160.46 82.44 Favored Pre-proline 0 CA--C 1.558 1.288 0 C-N-CA 123.842 0.857 . . . . 0.0 111.519 170.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -80.1 61.5 8.22 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.483 2.788 . . . . 0.0 113.522 -173.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -136.3 43.36 2.49 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.203 -0.935 . . . . 0.0 111.952 176.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 m -50.33 125.27 12.22 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.542 1.537 . . . . 0.0 112.942 -175.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.84 151.47 23.06 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . 58.77 30.47 20.06 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 116.104 1.89 . . . . 0.0 116.104 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.6 mt -137.85 99.22 9.33 Favored Pre-proline 0 CA--C 1.554 1.123 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 173.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.81 60.33 6.69 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 124.298 3.332 . . . . 0.0 112.424 -179.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.73 49.72 0.32 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.004 1.721 . . . . 0.0 113.675 -178.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.23 -22.36 66.92 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 120.134 -1.603 . . . . 0.0 112.13 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -89.54 -2.36 58.32 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 176.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -153.43 157.83 40.51 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 120.774 1.624 . . . . 0.0 113.894 -173.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.97 36.92 25.62 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -56.51 -22.5 33.23 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.393 1.877 . . . . 0.0 114.49 -173.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -116.3 -51.37 2.62 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.48 1.912 . . . . 0.0 111.351 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -160.15 -31.54 0.06 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 176.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 175.2 -144.93 7.56 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 124.071 0.843 . . . . 0.0 112.298 -169.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.3 -177.55 3.53 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.765 2.977 . . . . 0.0 111.436 171.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 m -154.48 -22.42 0.13 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.968 -1.082 . . . . 0.0 113.651 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -148.56 16.96 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 124.333 1.053 . . . . 0.0 111.61 -178.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.7 -153.86 46.31 Favored Glycine 0 CA--C 1.543 1.784 0 O-C-N 119.862 -1.774 . . . . 0.0 112.267 -154.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -91.3 70.77 6.12 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.08 0.952 . . . . 0.0 112.933 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -154.8 71.06 0.79 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.589 1.555 . . . . 0.0 110.049 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 53.0 mt -150.44 -57.92 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 126.508 1.923 . . . . 0.0 109.144 -173.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 16.6 mtm180 -136.51 13.16 3.23 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.725 2.01 . . . . 0.0 111.379 160.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -125.1 -3.26 7.58 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.37 1.868 . . . . 0.0 113.948 -158.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -75.3 -95.86 0.14 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-N 119.295 0.952 . . . . 0.0 111.103 173.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -150.06 -39.53 0.14 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.475 1.11 . . . . 0.0 112.417 164.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 52.1 m -140.51 79.29 1.7 Allowed 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 122.55 1.166 . . . . 0.0 109.046 174.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -84.23 161.95 20.34 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.193 1.397 . . . . 0.0 111.02 177.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.82 -7.96 55.73 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 175.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . 0.288 1.1 mp 68.79 148.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.245 2.218 . . . . 0.0 114.047 -176.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . 59.67 114.06 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 128.049 2.54 . . . . 0.0 115.277 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . 0.316 17.1 pt-20 39.08 -133.72 0.15 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.21 1.804 . . . . 0.0 115.751 -177.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 2.1 pt -147.45 -68.51 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 C-N-CA 125.94 1.696 . . . . 0.0 112.256 -168.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -159.37 -66.13 0.08 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.668 1.187 . . . . 0.0 110.684 -175.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.01 -74.11 0.33 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.633 1.173 . . . . 0.0 111.601 169.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 47.0 m-20 -139.97 160.1 40.68 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 126.022 1.729 . . . . 0.0 108.423 164.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -161.03 -36.74 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . 54.34 15.13 0.9 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 116.62 2.081 . . . . 0.0 116.62 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.31 -70.25 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 126.484 1.914 . . . . 0.0 111.549 -161.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -147.8 143.19 27.32 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.27 1.828 . . . . 0.0 109.208 165.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 152.78 -10.36 0.58 Allowed Glycine 0 CA--C 1.53 1.005 0 C-N-CA 124.132 0.872 . . . . 0.0 114.761 179.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -123.15 92.81 3.78 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.965 1.706 . . . . 0.0 110.489 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -165.98 -74.27 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.098 1.759 . . . . 0.0 110.09 165.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.53 -45.73 0.09 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 t -139.38 -122.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 124.824 1.25 . . . . 0.0 109.367 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.1 146.13 13.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.922 1.289 . . . . 0.0 109.365 175.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -165.18 -178.07 38.11 Favored Glycine 0 N--CA 1.478 1.465 0 C-N-CA 123.756 0.693 . . . . 0.0 114.356 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 179.87 58.76 0.08 OUTLIER Glycine 0 CA--C 1.533 1.191 0 N-CA-C 116.24 1.256 . . . . 0.0 116.24 -174.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -157.34 -166.94 17.67 Favored Glycine 0 N--CA 1.478 1.452 0 C-N-CA 124.494 1.045 . . . . 0.0 113.721 173.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.41 141.75 20.61 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 118.171 0.986 . . . . 0.0 112.781 162.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 93.7 t -94.14 158.8 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.9 1.68 . . . . 0.0 109.014 158.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.3 tp . . . . . 0 N--CA 1.482 1.125 0 C-N-CA 127.501 2.32 . . . . 0.0 114.975 -174.087 . . . . . . . . 0 0 . 1 stop_ save_